---
instrument_id: '470'
data_file_original_name: '20220710_FIGAERO_MassSpec.csv'
skip_headers: '1'
charts: ''
headers:
    - 'm_q'
    - 'CPS (or normalized signal)'
    - 'Ion'
dataset_id: '4195'
experiment_link: 'https://icarus.ucdavis.edu/chambers/542/experiments/853'
experiment_set_link: 'https://icarus.ucdavis.edu/chambers/542/experimentSets/256'
chamber_link: 'https://icarus.ucdavis.edu/chambers/542'
dataset_created_at: '2022-11-23 20:30:50'
dataset_updated_at: '2022-11-23 20:30:50'
instrument_link: 'https://icarus.ucdavis.edu/chambers/542/instruments/470'
instrument:
    id: '470'
    short_name: 'FIGAERO-HR-ToF-CIMS (far, particle, mass spec)'
    full_name: 'Filter Inlet for Gases and AEROsols coupled to High Resolution Time-of-Flight Iodide Chemical Ionization Mass Spectrometer'
    manufacturer: 'Aerodyne Research Inc.'
    model: 'N/A'
    year: ''
    data_recording_software: 'TofDAQ recorder'
    data_analysis_software: 'Tofware'
    raw_data_time_resolution: '1 Hz'
    analysis_data_averaging: '1s'
    detection_limit: 'N/A'
    quantification_limit: ''
    sensitivity_to_temperature: 'Not known'
    sensitivity_to_relative_humidity: 'Sensitivity varies depending on water vapor pressure in IMR. We add excess water vapors directly to IMR so H2O·I- does not varies substantially.'
    sampling_method: 'Direct sampling for gas-phase measurement. Filter collection followed by thermal desorption for particle-phase measurement.'
    sample_preparation_method: 'N/A'
    sample_residence_time_in_seconds: ''
    length_of_tubing_in_cm: '450'
    flow_rate: '0.4-6.8 lpm'
    tubing_material: 'FEP teflon / stainless steel'
    chemical_identification_method: 'Mass spectrometry technique with selective ionization toward polar species (e.g., organic acids, polyols, multi-functional, nitrates, some inorganic species etc) by iodide ions. Though the resolving power (4000-5500 depending on tuning) is limited, mass assignment is done carefully based on knowledge on iodide selectivity and precursor VOC chemistry.'
    data_analysis_method: "Raw data (1 Hz) are averaged to 10-s data using Tofware 2.5.1x in Igor 6.\r\nTake a close look at diagnostic data (e.g., pressures, temperatures, flow readings) and remove data points if abnormal.\r\nInstrument functions\r\nBaseline is determined using either smooth or median average routine built in Tofware using an integration width of 15 to account for a large negative mass defect of iodide ion.\r\nPeak width as a function of m/z is determined using a built-in algorithm in Tofware using a tolerance of 5 to 10.\r\nPeak shape is determined using a built-in algorithm in Tofware and manually removing ions with bad shapes.\r\nTime-series mass calibration built in Tofware, in general, is done at 1-min interval, using I-, H2O·I-, CHOOH·I-, HNO3·I-, CF3COOH·I-, I2-, and I3- as mass calibrants. Exact choice changes depending on types of experiments. Peak search range of 10, fit type of custom shape, and 2-param fit equation are generally used though they vary depending on application.\r\nHigh resolution peak fitting routine is performed following Stark et al. (2015, IJMS) and based on known precursor VOC chemistry as well as knowledge on iodide selectivity.\r\nBatch HR calculation is done by using fully constrained fitting, applying ToF duty cycle at m/z 127 (I-), subtracting baseline before fitting, and constraining isotopes and reallocating signals. Calculated signals are then normalized by ([I-]+[H2O·I-]/106) and dilution factor if used."
    quantification_method: 'All signals are normalized by ([I-]+[H2O·I-]/106) to account for changes in abundance of reagent ions over time. When dilution flow is desired and employed (not to deplete reagent ions and not to have secondary ion chemistry), signals are further corrected accordingly. Signals from particle-phase measurements are converted to gas-phase measurement equivalent signals based on the collection volume, gas-phase sampling flow rate,'
    calibration_method: "We do 2 types of calibrations: sensitivity and volatility calibration.\r\nFor sensitivity calibration, we either flow a known concentration of analyte (e.g., permeation tube) to gas-phase inlet and measure signal at multiple levels of concentration, or we deposit a known mass of analyte on filter (FIGAERO), desorb it and measure signal at multiple levels of mass.\r\nFor volatility calibration, we deposit a mixture of species with known subcooled vapor pressures (e.g., organic acids, polyols) and relate them to the desorption temperature (Tmax) obtained by a Gaussian fit."
    calibration_drift_estimate: 'No estimate'
    calibration_schedule: 'As Needed'
    uncertainty_estimation_method: 'We use an error provided by Tofware.'
    known_interferences: 'Changes in water vapor pressure in IMR changes sensitivity greatly, especially at a lower end of vapor pressure.'
    link_to_supplemental_information: ''
    additional_notes: ''
    organization_id: '546'
    created_at: '2020-12-07T02:33:31.000000Z'
    updated_at: '2020-12-07T02:33:31.000000Z'
    column_descriptors: '[]'
    sampling_protocol: 'Online'
    skip_headers: '1'
    tubing_inner_diameter: '1/4 inch'
    what_is_measured: 'Gas/Particle composition'
    measurement_uncertainty: 'NA'
    measurement_units: 'hz'

---
m_q,CPS (or normalized signal),Ion
172.911,0.00197201,'(I)CH2O2-'
186.926,6.86E-05,'(I)C2H4O2-'
186.937,2.03E-05,'(I)CH4N2O-'
199.921,4.97E-06,'(I)C2H3NO2-'
200.905,0.000136513,'(I)C2H2O3-'
200.942,9.86E-06,'(I)C3H6O2-'
201.913,6.73E-05,'(I)C2H3O3-'
201.937,2.66E-05,'(I)C2H5NO2-'
202.921,0.000265612,'(I)C2H4O3-'
212.905,1.25E-05,'C3H2IO3-'
213.937,1.64E-06,'(I)C3H5NO2-'
214.921,0.000519048,'(I)C3H4O3-'
214.957,3.51E-06,'(I)C4H8O2-'
215.916,-7.42E-06,'(I)C2H3NO3-'
215.953,0.00023969,'(I)C3H7NO2-'
216.9,-0.000293872,'(I)C2H2O4-'
216.937,6.50E-05,'(I)C3H6O3-'
218.916,3.60E-05,'C2H4IO4-'
218.952,-1.28E-06,'C3H8IO3-'
224.905,-0.00229274,'(I)C4H2O3-'
224.942,3.62E-05,'(I)C5H6O2-'
226.921,8.25E-06,'C4H4IO3-'
227.916,0.00018828,'C3H3INO3-'
227.953,1.52E-06,'C4H7INO2-'
228.9,-4.37E-07,'(I)C3H2O4-'
228.937,0.000529547,'C4H6IO3-'
229.932,2.17E-05,'C3H5INO3-'
229.968,4.32E-06,'(I)C4H9NO2-'
230.916,-0.000242664,'(I)C3H4O4-'
230.952,-3.30E-05,'(I)C4H8O3-'
231.911,7.93E-06,'C2H3INO4-'
231.948,1.22E-05,'(I)C3H7NO3-'
232.932,8.49E-05,'(I)C3H6O4-'
232.968,4.82E-05,'(I)C4H10O3-'
240.937,-1.32E-05,'C5H6IO3-'
241.932,2.08E-05,'(I)C4H5NO3-'
241.968,5.78E-06,'(I)C5H9NO2-'
242.916,3.20E-05,'C4H4IO4-'
242.952,9.95E-05,'C5H8IO3-'
242.989,5.47E-05,'(I)C6H12O2-'
243.911,3.62E-06,'C3H3INO4-'
243.948,9.94E-07,'C4H7INO3-'
243.984,-1.84E-06,'(I)C5H11NO2-'
244.895,4.32E-06,'(I)C3H2O5-'
244.932,2.67E-05,'C4H6IO4-'
244.968,-3.00E-05,'C5H10IO3-'
245.004,0.000126029,'(I)C6H14O2-'
245.927,0.00360423,'C3H5INO4-'
246.911,-2.00E-06,'(I)C3H4O5-'
246.947,-7.10E-07,'(I)C4H8O4-'
246.984,3.88E-05,'(I)C5H12O3-'
247.906,0.000324281,'C2H3INO5-'
250.906,-9.73E-06,'(I)C2H4O6-'
250.957,0.000763401,'(I)C7H8O2-'
251.916,0.000873553,'C5H3INO3-'
251.953,3.11E-05,'C6H7INO2-'
252.9,8.12E-06,'C5H2IO4-'
252.937,-4.15E-08,'C6H6IO3-'
252.973,0.000169831,'(I)C7H10O2-'
254.952,3.47E-05,'C6H8IO3-'
255.911,-7.66E-06,'C4H3INO4-'
255.948,-1.84E-05,'C5H7INO3-'
256.932,0.000299755,'C5H6IO4-'
256.968,0.000133197,'C6H10IO3-'
257.004,2.86E-05,'(I)C7H14O2-'
257.927,7.45E-06,'C4H5INO4-'
257.963,-5.99E-07,'C5H9INO3-'
258,4.92E-06,'(I)C6H13NO2-'
258.911,1.00E-05,'C4H4IO5-'
258.947,7.36E-05,'C5H8IO4-'
258.984,-7.77E-06,'C6H12IO3-'
259.02,5.32E-05,'C7H16IO2-'
259.906,3.82E-05,'C3H3INO5-'
259.943,1.21E-05,'C4H7INO4-'
260.927,1.95E-05,'C4H6IO5-'
260.963,-1.31E-05,'C5H10IO4-'
260.999,4.57E-05,'(I)C6H14O3-'
261.922,0.000110891,'C3H5INO5-'
261.973,3.49E-06,'C8H9INO-'
265.932,4.53E-05,'(I)C6H5NO3-'
265.968,3.39E-05,'(I)C7H9NO2-'
266.005,3.96E-05,'(I)C8H13NO-'
266.916,1.77E-05,'(I)C6H4O4-'
266.952,0.000352147,'(I)C7H8O3-'
266.989,4.45E-05,'(I)C8H12O2-'
267.911,1.62E-06,'(I)C5H3NO4-'
267.948,-5.35E-07,'(I)C6H7NO3-'
267.984,5.05E-05,'(I)C7H11NO2-'
268.895,1.07E-05,'(I)C5H2O5-'
268.932,1.38E-05,'C6H6IO4-'
268.968,0.00192243,'C7H10IO3-'
269.004,0.000117312,'(I)C8H14O2-'
269.927,2.45E-06,'C5H5INO4-'
269.963,-7.90E-07,'C6H9INO3-'
270,9.57E-05,'(I)C7H13NO2-'
270.911,1.19E-05,'C5H4IO5-'
270.947,0.000294281,'C6H8IO4-'
270.984,0.00180819,'C7H12IO3-'
271.02,5.34E-05,'(I)C8H16O2-'
271.906,3.26E-06,'C4H3INO5-'
271.943,2.97E-06,'C5H7INO4-'
271.979,3.36E-08,'C6H11INO3-'
272.015,7.85E-05,'C7H15INO2-'
272.927,6.58E-05,'C5H6IO5-'
272.963,0.000105096,'C6H10IO4-'
272.999,1.23E-05,'C7H14IO3-'
273.922,6.54E-06,'C4H5INO5-'
273.958,-3.87E-06,'C5H9INO4-'
273.995,0.000208888,'(I)C6H13NO3-'
274.906,-5.44E-05,'C4H4IO6-'
274.942,5.60E-05,'C5H8IO5-'
274.979,6.22E-05,'C6H12IO4-'
275.901,1.21E-05,'C3H3INO6-'
275.937,1.43E-05,'C4H7INO5-'
275.974,3.50E-05,'C5H11INO4-'
277.917,7.63E-05,'C3H5INO6-'
280.895,0.000196594,'(I)C6H2O5-'
280.932,0.000127537,'(I)C7H6O4-'
280.968,0.000181226,'(I)C8H10O3-'
281.004,4.83E-05,'(I)C9H14O2-'
281.927,4.38E-06,'(I)C6H5NO4-'
281.963,0.000136442,'(I)C7H9NO3-'
282,2.67E-05,'(I)C8H13NO2-'
282.911,5.45E-06,'C6H4IO5-'
282.947,0.000798299,'C7H8IO4-'
282.984,0.000145942,'C8H12IO3-'
283.02,4.38E-05,'C9H16IO2-'
283.906,9.00E-07,'(I)C5H3NO5-'
283.943,8.32E-06,'(I)C6H7NO4-'
283.979,6.53E-05,'(I)C7H11NO3-'
284.927,2.37E-05,'C6H6IO5-'
284.963,0.00318058,'C7H10IO4-'
284.999,0.000126477,'C8H14IO3-'
285.036,4.16E-05,'(I)C9H18O2-'
285.885,8.10E-07,'(I)C4HNO6-'
285.922,1.61E-06,'C5H5INO5-'
285.958,5.97E-05,'C6H9INO4-'
285.995,7.97E-05,'(I)C7H13NO3-'
286.906,0.000142617,'C5H4IO6-'
286.942,0.000298587,'C6H8IO5-'
286.979,0.00044047,'C7H12IO4-'
287.015,5.47E-05,'C8H16IO3-'
287.901,1.40E-05,'C4H3INO6-'
287.937,6.61E-05,'C5H7INO5-'
287.974,7.96E-05,'C6H11INO4-'
288.921,5.33E-05,'C5H6IO6-'
288.958,0.000138862,'C6H10IO5-'
288.994,7.26E-05,'C7H14IO4-'
289.917,2.53E-05,'C4H5INO6-'
289.953,3.39E-06,'C5H9INO5-'
289.989,0.000166285,'(I)C6H13NO4-'
290.973,9.78E-05,'(I)C6H12O5-'
293.004,0.000211045,'(I)C10H14O2-'
293.912,-1.09E-06,'(I)C3H5NO7-'
293.948,5.88E-05,'(I)C4H9NO6-'
294.947,4.16E-05,'(I)C8H8O4-'
294.984,0.000531009,'(I)C9H12O3-'
295.02,8.87E-05,'(I)C10H16O2-'
295.943,0.000337716,'(I)C7H7NO4-'
296.927,5.53E-05,'C7H6IO5-'
296.963,0.00112221,'C8H10IO4-'
296.999,0.000564901,'C9H14IO3-'
297.036,8.69E-05,'(I)C10H18O2-'
297.922,6.67E-06,'(I)C6H5NO5-'
297.958,0.000410878,'(I)C7H9NO4-'
297.995,2.05E-05,'(I)C8H13NO3-'
298.031,2.36E-05,'(I)C9H17NO2-'
298.906,0.00137161,'C6H4IO6-'
298.942,0.00246543,'C7H8IO5-'
298.979,0.000118832,'C8H12IO4-'
299.015,0.000231619,'C9H16IO3-'
299.901,7.24E-06,'(I)C5H3NO6-'
299.937,9.05E-05,'(I)C6H7NO5-'
299.974,0.000918349,'(I)C7H11NO4-'
300.01,4.77E-05,'(I)C8H15NO3-'
300.921,0.000141453,'C6H6IO6-'
300.958,0.000834825,'C7H10IO5-'
300.994,5.76E-05,'C8H14IO4-'
301.031,1.27E-05,'C9H18IO3-'
301.88,3.07E-06,'(I)C4HNO7-'
301.917,3.28E-06,'(I)C5H5NO6-'
301.953,0.000167586,'(I)C6H9NO5-'
301.989,0.000175495,'C7H13INO4-'
302.901,-1.29E-05,'C5H4IO7-'
302.937,8.94E-05,'C6H8IO6-'
302.973,0.000756421,'C7H12IO5-'
303.01,3.83E-05,'C8H16IO4-'
303.932,0.000108447,'C5H7INO6-'
303.969,9.18E-05,'C6H11INO5-'
304.005,7.03E-05,'(I)C7H15NO4-'
304.953,0.000134046,'C6H10IO6-'
304.989,0.000156881,'C7H14IO5-'
305.912,-3.06E-06,'C4H5INO7-'
305.948,9.05E-06,'C5H9INO6-'
305.984,0.000187342,'(I)C6H13NO5-'
306.984,0.000556222,'(I)C10H12O3-'
308.927,1.75E-05,'C8H6IO5-'
308.963,0.000225068,'(I)C9H10O4-'
308.999,0.000947803,'(I)C10H14O3-'
309.036,0.000219608,'C11H18IO2-'
310.979,0.000743944,'(I)C9H12O4-'
311.015,0.00157926,'(I)C10H16O3-'
312.921,0.000108358,'(I)C7H6O6-'
312.958,0.000115995,'C8H10IO5-'
312.994,0.00644759,'(I)C9H14O4-'
313.031,0.000243713,'C10H18IO3-'
313.917,2.45E-05,'(I)C6H5NO6-'
313.953,0.00217963,'C7H9INO5-'
313.989,5.92E-05,'C8H13INO4-'
314.026,0.000102114,'C9H17INO3-'
314.937,0.000829484,'C7H8IO6-'
314.973,0.000174721,'C8H12IO5-'
315.01,0.000153163,'C9H16IO4-'
315.896,2.46E-05,'(I)C5H3NO7-'
315.932,9.77E-05,'(I)C6H7NO6-'
315.969,0.00751551,'(I)C7H11NO5-'
316.005,0.000245973,'(I)C8H15NO4-'
316.916,0.000497992,'(I)C6H6O7-'
316.953,0.000661481,'(I)C7H10O6-'
316.989,1.44E-05,'(I)C8H14O5-'
317.912,1.11E-05,'C5H5INO7-'
317.948,0.000200011,'(I)C6H9NO6-'
317.984,0.0033084,'(I)C7H13NO5-'
318.021,0.000100576,'C8H17INO4-'
319.927,-2.96E-05,'C5H7INO7-'
319.964,0.000286114,'C6H11INO6-'
322.942,-1.02E-05,'(I)C9H8O5-'
322.979,0.000676334,'(I)C10H12O4-'
323.015,7.67E-05,'(I)C11H16O3-'
324.958,0.000119565,'(I)C9H10O5-'
324.994,0.00169399,'(I)C10H14O4-'
325.938,2.63E-05,'(I)C4H9NO8-'
325.953,4.79E-05,'C8H9INO5-'
325.989,9.17E-05,'C9H13INO4-'
326.937,0.000230505,'C8H8IO6-'
326.973,0.000702228,'C9H12IO5-'
327.01,0.0034595,'(I)C10H16O4-'
327.932,0.000155069,'C7H7INO6-'
327.969,0.000328876,'C8H11INO5-'
328.005,7.98E-05,'C9H15INO4-'
328.042,6.98E-05,'C10H19INO3-'
328.916,1.52E-05,'(I)C7H6O7-'
328.953,0.000190911,'C8H10IO6-'
328.989,0.000694739,'C9H14IO5-'
329.026,0.000100217,'C10H18IO4-'
329.912,1.21E-05,'C6H5INO7-'
329.948,0.00102182,'C7H9INO6-'
329.984,0.000364904,'C8H13INO5-'
330.021,0.000169847,'C9H17INO4-'
330.932,0.000368585,'(I)C7H8O7-'
330.968,9.22E-05,'(I)C8H12O6-'
331.005,9.12E-05,'(I)C9H16O5-'
331.041,3.10E-05,'C10H20IO4-'
331.927,9.75E-05,'C6H7INO7-'
331.964,0.00196511,'C7H11INO6-'
332,0.000158368,'C8H15INO5-'
332.911,0.000148613,'(I)C6H6O8-'
332.948,0.000262346,'(I)C7H10O7-'
332.984,6.93E-05,'(I)C8H14O6-'
333.02,5.23E-05,'(I)C9H18O5-'
333.907,1.36E-06,'C5H5INO8-'
333.943,0.000232041,'C6H9INO7-'
333.979,0.000821138,'C7H13INO6-'
334.016,3.41E-05,'C8H17INO5-'
336.921,1.25E-05,'(I)C9H6O6-'
336.954,3.95E-05,'(I)C5H10N2O7-'
336.958,7.56E-05,'(I)C10H10O5-'
337.953,2.27E-05,'C9H9INO5-'
337.989,0.00192987,'C10H13INO4-'
338.937,0.00133197,'(I)C9H8O6-'
338.973,0.00209698,'(I)C10H12O5-'
339.01,7.32E-06,'(I)C11H16O4-'
339.932,1.33E-06,'(I)C8H7NO6-'
339.969,0.000133022,'(I)C9H11NO5-'
340.005,0.00148151,'(I)C10H15NO4-'
340.953,0.00223837,'C9H10IO6-'
340.989,0.00348615,'C10H14IO5-'
341.948,0.000245624,'(I)C8H9NO6-'
341.984,0.00199849,'(I)C9H13NO5-'
342.021,0.0016676,'(I)C10H17NO4-'
342.932,0.000169131,'C8H8IO7-'
342.968,0.000342486,'C9H12IO6-'
343.005,0.00104693,'C10H16IO5-'
343.927,0.000267921,'C7H7INO7-'
343.964,0.00918708,'C8H11INO6-'
344,0.00963895,'C9H15INO5-'
344.911,2.78E-05,'(I)C7H6O8-'
344.948,0.000311033,'C8H10IO7-'
344.984,0.000312651,'C9H14IO6-'
345.02,0.000155728,'C10H18IO5-'
345.943,0.00147458,'C7H9INO7-'
345.979,0.00109456,'C8H13INO6-'
346.016,0.000363294,'C9H17INO5-'
346.927,-3.64E-06,'(I)C7H8O8-'
346.963,0.000835821,'(I)C8H12O7-'
347,0.000403664,'(I)C9H16O6-'
347.036,9.34E-08,'(I)C10H20O5-'
347.922,2.27E-05,'C6H7INO8-'
347.959,0.000786077,'C7H11INO7-'
347.995,8.44E-05,'C8H15INO6-'
348.906,9.81E-06,'(I)C6H6O9-'
348.921,9.83E-05,'(I)C10H6O6-'
348.943,3.63E-05,'(I)C7H10O8-'
348.979,6.67E-05,'(I)C8H14O7-'
349.938,5.47E-05,'(I)C6H9NO8-'
349.974,0.000205482,'(I)C7H13NO7-'
350.011,2.72E-05,'(I)C8H17NO6-'
351.969,0.000667947,'C10H11INO5-'
352.949,0.00054405,'(I)C5H10N2O8-'
352.953,-5.18E-05,'(I)C10H10O6-'
353.948,0.000145091,'(I)C9H9NO6-'
353.984,0.00254415,'(I)C10H13NO5-'
354.932,0.000958809,'(I)C9H8O7-'
354.968,0.00125558,'(I)C10H12O6-'
355.005,0.000404633,'(I)C11H16O5-'
355.964,0.000713132,'(I)C9H11NO6-'
356,0.0188909,'(I)C10H15NO5-'
356.948,0.00133441,'C9H10IO7-'
356.984,0.00244651,'C10H14IO6-'
357.943,0.000250552,'C8H9INO7-'
357.979,0.00478231,'(I)C9H13NO6-'
358.016,0.0120612,'(I)C10H17NO5-'
358.052,0.000909874,'(I)C11H21NO4-'
358.927,0.000263832,'(I)C8H8O8-'
358.963,0.000531526,'C9H12IO7-'
359,0.000995254,'C10H16IO6-'
359.922,0.000149513,'C7H7INO8-'
359.959,0.0134688,'C8H11INO7-'
359.995,0.00364221,'C9H15INO6-'
360.031,0.000581427,'C10H19INO5-'
360.906,0.000112756,'(I)C7H6O9-'
360.943,1.36E-05,'(I)C8H10O8-'
360.954,0.000299518,'C7H10IN2O7-'
360.979,0.000121348,'(I)C9H14O7-'
361.015,0.000132294,'(I)C10H18O6-'
361.901,2.17E-05,'C6H5INO9-'
361.938,0.000440919,'C7H9INO8-'
361.974,0.00174641,'C8H13INO7-'
362.011,0.000890602,'C9H17INO6-'
362.922,8.71E-05,'(I)C7H8O9-'
362.958,5.00E-05,'(I)C8H12O8-'
362.969,0.000682095,'C7H12IN2O7-'
362.995,0,'(I)C9H16O7-'
363.031,0.000118601,'(I)C10H20O6-'
363.917,6.72E-06,'(I)C6H7NO9-'
363.953,0.000485331,'(I)C7H11NO8-'
363.99,0.000163648,'(I)C8H15NO7-'
364.026,4.03E-05,'(I)(NO3)C9H19O3-'
364.912,7.22E-05,'C5H6IN2O9-'
367.964,0.00114542,'C10H11INO6-'
369.979,0.00797882,'(I)C10H13NO6-'
370.927,0.000303288,'(I)C9H8O8-'
370.963,0.000635727,'(I)C10H12O7-'
371.995,0.128226,'(I)C10H15NO6-'
372.954,0.00145001,'C8H10IN2O7-'
372.99,0.000564925,'C9H14IN2O6-'
373.938,0.000312823,'(I)C8H9NO8-'
373.974,0.0036892,'C9H13INO7-'
374.011,0.00977032,'(I)C10H17NO6-'
374.922,9.67E-05,'(I)C8H8O9-'
374.958,0.000391018,'(I)C9H12O8-'
374.969,0.000300345,'C8H12IN2O7-'
374.995,0.000450893,'C10H16IO7-'
375.917,9.09E-06,'(I)C7H7NO9-'
375.953,0.000939208,'C8H11INO8-'
375.99,0.00641724,'C9H15INO7-'
376.026,0.000852434,'C10H19INO6-'
376.901,0.000219027,'(I)C7H6O10-'
376.938,5.69E-05,'(I)C8H10O9-'
376.949,0.000615233,'C7H10IN2O8-'
376.974,5.52E-05,'(I)C9H14O8-'
376.985,0.000194816,'C8H14IN2O7-'
377.969,0.00105073,'C8H13INO8-'
378.006,0.000258796,'C9H17INO7-'
378.042,6.01E-05,'C10H21INO6-'
378.928,0.000104942,'(I)C6H8N2O9-'
378.964,0.000228631,'(I)C7H12N2O8-'
379.001,0.000116545,'(I)C8H16N2O7-'
383.145,3.92E-05,'C16H32IO2-'
383.922,4.87E-05,'(I)C9H7NO8-'
383.959,0.000670372,'(I)C10H11NO7-'
383.995,0.000293885,'(I)C11H15NO6-'
384.031,0.000109131,'C12H19INO5-'
384.99,0.00099145,'C10H14IN2O6-'
385.974,0.0121808,'(I)C10H13NO7-'
386.011,0.000990974,'C11H17INO6-'
386.922,0.000148573,'C9H8IO9-'
386.958,0.000257231,'C10H12IO8-'
387.006,0.000780166,'(I)C10H16N2O6-'
387.99,0.0929039,'(I)C10H15NO7-'
388.026,0.00461929,'C11H19INO6-'
388.938,0.00060318,'(I)C9H10O9-'
388.949,6.97E-05,'C8H10IN2O8-'
388.974,4.85E-05,'(I)C10H14O8-'
388.985,0.00118865,'(I)C9H14N2O7-'
389.933,2.71E-05,'C8H9INO9-'
389.969,0.00144699,'C9H13INO8-'
390.006,0.00817466,'(I)C10H17NO7-'
390.042,0.000526182,'(I)C11H21NO6-'
390.917,9.86E-05,'(I)C8H8O10-'
390.953,5.22E-05,'(I)C9H12O9-'
390.964,1.58E-05,'C8H12IN2O8-'
390.99,0.000587202,'C10H16IO8-'
391.912,6.41E-06,'(I)C7H7NO10-'
391.948,0.000123207,'(I)C8H11NO9-'
391.985,0.000998737,'(I)C9H15NO8-'
392.021,7.16E-05,'(I)C10H19NO7-'
392.058,0.000121763,'(I)C11H23NO6-'
392.944,0.000104313,'(I)C7H10N2O9-'
392.98,7.23E-05,'(I)C8H14N2O8-'
393.928,4.62E-05,'(I)C7H9NO10-'
394,0.000357643,'(I)C9H17NO8-'
394.037,3.53E-05,'(I)C10H21NO7-'
399.938,0.00125819,'(I)C6H11NO11-'
399.953,4.41E-05,'(I)C10H11NO8-'
399.975,5.28E-05,'C7H15INO10-'
399.99,0.00018702,'(I)C11H15NO7-'
400.938,1.27E-05,'(I)C10H10O9-'
400.949,0.000235768,'C9H10IN2O8-'
400.985,0.00167577,'(I)C10H14N2O7-'
401.022,0.000396917,'C11H18IN2O6-'
401.933,0.000180565,'(I)C9H9NO9-'
401.969,0.00318005,'(I)C10H13NO8-'
402.006,0.000501488,'C11H17INO7-'
402.042,0.000240548,'C12H21INO6-'
402.953,0.000502545,'(I)C10H12O9-'
403.001,0.0179052,'(I)C10H16N2O7-'
403.948,0.000737579,'C9H11INO9-'
403.985,0.0136444,'(I)C10H15NO8-'
404.021,0.000929665,'C11H19INO7-'
404.969,0.000697266,'C10H14IO9-'
404.98,0.000276396,'C9H14IN2O8-'
405.016,0.000232889,'(I)C10H18N2O7-'
405.928,0.000143898,'C8H9INO10-'
405.964,0.000171098,'C9H13INO9-'
406,0.0289313,'C10H17INO8-'
406.984,0.00037996,'C10H16IO9-'
407.943,0.000111883,'C8H11INO10-'
407.98,0.000149301,'C9H15INO9-'
408.016,5.46E-05,'C10H19INO8-'
408.052,8.86E-05,'C11H23INO7-'
411.177,2.25E-05,'(I)C18H36O2-'
415.948,0.000315398,'C10H11INO9-'
416.98,0.00365183,'(I)C10H14N2O8-'
417.928,0.000482139,'(I)C9H9NO10-'
417.949,0.00301801,'C6H13INO12-'
417.964,6.66E-05,'C10H13INO9-'
418,0.000676124,'(I)C11H17NO8-'
418.948,0.000248086,'(I)C10H12O10-'
418.996,0.0468078,'(I)C10H16N2O8-'
419.943,0.000946284,'C9H11INO10-'
419.98,0.00327202,'C10H15INO9-'
420.964,0.000225353,'(I)C10H14O10-'
420.975,9.15E-05,'(I)C9H14N2O9-'
421.011,0.0626081,'(I)C10H18N2O8-'
421.923,0.000397634,'(I)C8H9NO11-'
421.959,0.000267608,'(I)C9H13NO10-'
421.995,0.000977062,'(I)C10H17NO9-'
422.954,0.000249977,'C8H12IN2O10-'
422.991,0.000234069,'C9H16IN2O9-'
423.027,0.000140567,'C10H20IN2O8-'
432.975,0.00290745,'(I)C10H14N2O9-'
433.011,0.000313116,'C11H18IN2O8-'
433.923,0.000196218,'(I)C9H9NO11-'
433.959,0.000433506,'(I)C10H13NO10-'
434.943,0.000140626,'(I)C10H12O11-'
434.991,0.0126958,'(I)C10H16N2O9-'
435.938,0.000343168,'(I)C9H11NO11-'
435.975,0.000697407,'(I)C10H15NO10-'
436.97,0.000307276,'C9H14IN2O10-'
437.006,0.0100067,'C10H18IN2O9-'
437.954,0.000309554,'C9H13INO11-'
437.99,0.000409341,'C10H17INO10-'
446.954,7.55E-05,'(I)C10H12N2O10-'
446.991,0.000233894,'(I)C11H16N2O9-'
447.949,-3.02E-06,'(I)C9H11N3O10-'
447.986,0.00124677,'(I)C10H15N3O9-'
448.97,0.00210047,'(I)C10H14N2O10-'
449.006,0.00111112,'C11H18IN2O9-'
450.986,0.00135094,'(I)C10H16N2O10-'
451.97,0.000223503,'C10H15INO11-'
453.001,0.0011744,'C10H18IN2O10-'
463.022,0.000582551,'(I)C12H20N2O9-'
463.981,0.00152428,'(I)C10H15N3O10-'
464.042,0.00043767,'C13H23INO9-'
464.928,3.40E-05,'C9H10IN2O12-'
464.965,0.000582511,'(I)C10H14N2O11-'
465.96,0.000303286,'(I)C9H13N3O11-'
465.996,0.0063838,'(I)C10H17N3O10-'
466.073,0.00011521,'(I)C17H25NO6-'
466.11,0.000281415,'(I)C18H29NO5-'
466.98,0.00298296,'(I)C10H16N2O11-'
467.057,0.000368761,'(I)C17H24O7-'
467.928,0.000152972,'C9H11INO13-'
467.964,0.000160526,'C10H15INO12-'
468.012,4.21E-05,'C10H19IN3O10-'
468.052,0.000293057,'(I)C16H23NO7-'
468.089,0.000170747,'(I)C17H27NO6-'
477.114,4.88E-05,'(I)C20H30O5-'
479.976,0.00019635,'(I)C10H15N3O11-'
480.012,0.000106735,'C11H19IN3O10-'
480.052,0.000427574,'C17H23INO7-'
480.089,1.91E-05,'(I)C18H27NO6-'
480.125,0.000105939,'(I)C19H31NO5-'
481.991,0.000431345,'(I)C10H17N3O11-'
482.032,0.000240734,'(I)C16H21NO8-'
482.068,0.00139394,'(I)C17H25NO7-'
482.105,0.00016417,'(I)C18H29NO6-'
483.934,4.47E-05,'C8H11IN3O13-'
483.971,3.41E-05,'C9H15IN3O12-'
484.007,1.98E-05,'(I)C10H19N3O11-'
484.047,0.000212025,'(I)C16H23NO8-'
484.084,0.000278292,'(I)C17H27NO7-'
484.12,5.87E-05,'C18H31INO6-'
486.063,0.000251666,'(I)C16H25NO8-'
490.094,0.000122426,'(I)C16H29NO8-'
491.053,0.000219229,'(I)C14H24N2O9-'
492.089,0.000150124,'(I)C19H27NO6-'
492.125,1.60E-06,'(I)C20H31NO5-'
494.105,8.14E-05,'(I)C19H29NO6-'
495.971,0.000128421,'(I)C10H15N3O12-'
496.011,2.97E-05,'C16H19INO9-'
496.047,0.000390857,'(I)C17H23NO8-'
496.084,5.38E-05,'(I)C18H27NO7-'
496.12,5.71E-05,'(I)C19H31NO6-'
497.986,0.000152966,'C10H17IN3O12-'
498.063,0.000793858,'(I)C17H25NO8-'
498.099,0.000120445,'(I)C18H29NO7-'
500.042,0.000268143,'(I)C16H23NO9-'
500.079,0.000309553,'(I)C17H27NO8-'
500.115,9.64E-05,'(I)C18H31NO7-'
503.017,0.000721113,'C14H20IN2O10-'
503.078,0.000135512,'C17H28IO9-'
505.032,0.000863344,'C14H22IN2O10-'
505.094,0.000138631,'C17H30IO9-'
510.099,0.000320185,'(I)C19H29NO7-'
510.981,0.000328541,'(I)C10H16N4O12-'
512.042,0.000250619,'C17H23INO9-'
512.079,0.000100364,'C18H27INO8-'
512.115,5.34E-05,'C19H31INO7-'
512.151,1.67E-05,'(I)C20H35NO6-'
514.058,0.000808336,'(I)C17H25NO9-'
514.094,0.000115076,'(I)C18H29NO8-'
515.053,0.000465574,'(I)C16H24N2O9-'
515.09,7.25E-05,'(I)C17H28N2O8-'
516.074,0.000355282,'(I)C17H27NO9-'
517.021,0.000102864,'(I)C16H22O11-'
517.032,4.69E-05,'(I)C15H22N2O10-'
517.058,0.000143155,'(I)C17H26O10-'
517.069,0.000194277,'(I)C16H26N2O9-'
517.094,4.50E-05,'(I)C18H30O9-'
517.105,0.000116996,'(I)C17H30N2O8-'
520.084,0.000239126,'(I)C20H27NO7-'
522.011,4.74E-05,'C14H21INO12-'
522.063,0.000100751,'C19H25INO8-'
522.099,0.000300913,'C20H29INO7-'
524.079,0.000275247,'C19H27INO8-'
524.115,0.000203306,'(I)C20H31NO7-'
526.058,0.000158841,'C18H25INO9-'
526.094,0.000142113,'C19H29INO8-'
526.131,7.70E-05,'C20H33INO7-'
526.167,2.56E-05,'(I)C21H37NO6-'
527.053,0.000728852,'(I)C17H24N2O9-'
527.09,1.84E-05,'(I)C18H28N2O8-'
528.074,0.000243132,'C18H27INO9-'
528.11,0.0001059,'C19H31INO8-'
529.069,0.00299723,'(I)C17H26N2O9-'
529.105,6.10E-05,'(I)C18H30N2O8-'
530.889,7.06E-06,'C10H15I2NO8-'
531.048,0.000751704,'(I)C16H24N2O10-'
531.085,0.00159388,'(I)C17H28N2O9-'
532.905,1.87E-06,'C10H17I2NO8-'
533.027,0.00012819,'C15H22IN2O11-'
533.064,0.000715332,'(I)C16H26N2O10-'
533.1,0.000154446,'C17H30IN2O9-'
536.079,0.000306982,'(I)C20H27NO8-'
537.11,0.000119373,'(I)C20H30N2O7-'
538.058,0.000132491,'C19H25INO9-'
538.094,0.000300545,'C20H29INO8-'
540.074,0.000151372,'C19H27INO9-'
540.11,0.000354541,'(I)C20H31NO8-'
541.105,0.000161005,'(I)C19H30N2O8-'
541.142,3.25E-05,'(I)C20H34N2O7-'
542.089,0.000371059,'(I)C19H29NO9-'
542.126,3.89E-05,'(I)C20H33NO8-'
543.048,0.000949086,'(I)C17H24N2O10-'
543.085,4.98E-05,'(I)C18H28N2O9-'
543.121,0.00013671,'(I)C19H32N2O8-'
544.032,6.91E-05,'(I)C17H23NO11-'
544.069,3.94E-05,'(I)C18H27NO10-'
544.105,0.000160006,'(I)C19H31NO9-'
545.064,0.00535954,'(I)C17H26N2O10-'
545.1,0.000261285,'(I)C18H30N2O9-'
546.048,0.000399424,'C17H25INO11-'
546.095,0.000159502,'C17H29IN3O9-'
547.043,0.000200675,'(I)C16H24N2O11-'
547.079,0.00218377,'(I)C17H28N2O10-'
552.074,0.000349872,'(I)C20H27NO9-'
552.162,4.20E-05,'(I)C26H35NO4-'
553.105,0.000242475,'C20H30IN2O8-'
554.089,0.000434044,'(I)C20H29NO9-'
555.085,0.000838397,'C19H28IN2O9-'
555.121,0.00162831,'(I)C20H32N2O8-'
556.105,0.000418817,'(I)C20H31NO9-'
557.1,0.00282479,'(I)C19H30N2O9-'
558.084,0.00028142,'(I)C19H29NO10-'
558.121,3.08E-05,'(I)C20H33NO9-'
559.043,0.000433681,'C17H24IN2O11-'
559.079,0.00116163,'(I)C18H28N2O10-'
559.116,3.97E-05,'(I)C19H32N2O9-'
560.063,0.000183278,'(I)C18H27NO11-'
560.1,0.00103486,'(I)C19H31NO10-'
560.136,0.000155818,'(I)C20H35NO9-'
561.059,0.00215807,'(I)C17H26N2O11-'
561.095,0.000235382,'(I)C18H30N2O10-'
563.074,0.00177841,'C17H28IN2O11-'
567.085,0.000731088,'(I)C20H28N2O9-'
569.1,0.00314078,'(I)C20H30N2O9-'
571.079,0.00239923,'C19H28IN2O10-'
571.116,0.00892042,'(I)C20H32N2O9-'
573.059,0.000504146,'C18H26IN2O11-'
573.095,0.00501909,'C19H30IN2O10-'
575.038,0.000566068,'(I)C17H24N2O12-'
575.074,0.000802482,'C18H28IN2O11-'
575.111,9.42E-05,'(I)C19H32N2O10-'
577.054,0.00170813,'C17H26IN2O12-'
579.069,0.00130018,'(I)C17H28N2O12-'
583.079,0.00201218,'C20H28IN2O10-'
585.095,0.00552946,'(I)C20H30N2O10-'
587.111,0.0138318,'(I)C20H32N2O10-'
589.09,0.00367729,'(I)C19H30N2O11-'
589.126,0.000431312,'C20H34IN2O10-'
590.049,0.00100135,'C17H25IN3O12-'
591.033,7.66E-05,'C17H24IN2O13-'
591.069,0.000179323,'C18H28IN2O12-'
591.106,0.00144681,'C19H32IN2O11-'
592.064,0.00265592,'C17H27IN3O12-'
594.08,0.00164498,'C17H29IN3O12-'
599.074,0.00159744,'C20H28IN2O11-'
599.111,3.48E-05,'(I)C21H32N2O10-'
600.106,0.000217817,'(I)C20H31N3O10-'
601.09,0.00459046,'(I)C20H30N2O11-'
602.074,0.000448471,'(I)C20H29NO12-'
603.106,0.007662,'(I)C20H32N2O11-'
604.09,0.000274474,'(I)C20H31NO12-'
605.049,0.00015779,'C18H26IN2O13-'
605.085,0.000869439,'(I)C19H30N2O12-'
605.121,0.000319917,'C20H34IN2O11-'
606.044,0.000784586,'C17H25IN3O13-'
607.064,7.08E-05,'(I)C18H28N2O13-'
607.101,0.000634027,'(I)C19H32N2O12-'
608.059,0.00235403,'C17H27IN3O13-'
610.075,0.00166103,'C17H29IN3O13-'
614.085,0.00109315,'C20H29IN3O11-'
615.069,0.00106342,'C20H28IN2O12-'
616.064,4.15E-05,'C19H27IN3O12-'
616.101,0.000913359,'(I)C20H31N3O11-'
617.085,0.00297741,'(I)C20H30N2O12-'
618.08,0.00158302,'(I)C19H29N3O12-'
618.117,0.000402573,'(I)C20H33N3O11-'
619.101,0.00430665,'(I)C20H32N2O12-'
620.059,0.000408016,'C18H27IN3O13-'
620.096,7.39E-05,'(I)C19H31N3O12-'
620.132,0.000528094,'C20H35IN3O11-'
621.08,0.000376019,'C19H30IN2O13-'
621.116,0.000105394,'C20H34IN2O12-'
622.039,0.000162103,'(I)C17H25N3O14-'
624.054,0.000328033,'(I)C17H27N3O14-'
626.07,0.000155749,'(I)C17H29N3O14-'
630.08,0.00334943,'(I)C20H29N3O12-'
631.052,0.000155645,'C19H26IN3O13-'
631.088,0.000233332,'C20H30IN3O12-'
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633.08,0.00200223,'(I)C20H30N2O13-'
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636.091,0.00374328,'C19H31IN3O13-'
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637.038,0.000223901,'C18H26IN2O15-'
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638.034,6.78E-05,'C17H25IN3O15-'
638.07,0.000146635,'C18H29IN3O14-'
638.106,0.000856895,'C19H33IN3O13-'
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648.091,0.00749621,'(I)C20H31N3O13-'
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650.106,0.0131395,'(I)C20H33N3O13-'
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653.044,0.000230685,'(I)C17H26N4O15-'
653.137,6.53E-05,'(I)C28H34N2O8-'
662.07,0.00133542,'(I)C20H29N3O14-'
662.106,0.000102864,'(I)C21H33N3O13-'
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668.081,0.0004163,'(I)C19H31N3O15-'
668.117,9.31E-05,'(I)C20H35N3O14-'
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676.111,0.000134642,'(I)C23H35NO14-'
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680.081,0.00563126,'(I)C20H31N3O15-'
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693.076,0.00109618,'(I)C20H30N4O15-'
693.153,3.27E-05,'(I)C27H38N2O11-'
694.081,0.000203306,'(I)C17H33N3O18-'
694.173,6.57E-05,'(I)C28H41NO11-'
695.091,0.00475994,'(I)C20H32N4O15-'
695.168,3.37E-06,'(I)C27H40N2O11-'
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705.225,1.19E-05,'(I)C30H46N2O9-'
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709.071,0.00415314,'(I)C20H30N4O16-'
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723.2,0.000119297,'(I)C29H44N2O11-'
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725.066,0.000110122,'(I)C20H30N4O17-'
725.215,2.09E-05,'(I)C29H46N2O11-'
726.174,0.000112588,'(I)C27H41N3O12-'
727.081,0.000565575,'(I)C20H32N4O17-'
727.158,6.64E-06,'(I)C27H40N2O13-'
727.194,4.46E-05,'(I)C28H44N2O12-'
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729.097,0.000135581,'(I)C20H34N4O17-'
730.169,0.000127172,'(I)C26H41N3O13-'
735.2,7.69E-05,'(I)C30H44N2O11-'
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739.194,9.86E-05,'(I)C29H44N2O12-'
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744.185,0.000155706,'(I)C27H43N3O13-'
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756.148,0.000111467,'(I)C27H39N3O14-'
757.205,5.13E-05,'(I)C29H46N2O13-'
758.087,0.000980401,'(I)C20H33N5O18-'
758.164,0.000203964,'(I)C27H41N3O14-'
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760.158,0.000103123,'(I)C30H39N3O12-'
760.18,0.000131577,'(I)C27H43N3O14-'
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767.189,4.97E-05,'(I)C30H44N2O13-'
768.221,5.67E-05,'(I)C30H47N3O12-'
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770.2,6.47E-05,'(I)C29H45N3O13-'
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774.159,0.00022724,'(I)C27H41N3O15-'
776.098,4.86E-05,'(I)C20H35N5O19-'
776.174,7.33E-05,'(I)C27H43N3O15-'
780.185,8.43E-05,'(I)C30H43N3O13-'
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788.174,9.89E-06,'(I)C28H43N3O15-'
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790.154,0.000100132,'(I)C27H41N3O16-'
792.169,5.82E-05,'(I)C27H43N3O16-'
798.195,0.000100366,'(I)C30H45N3O14-'
800.211,0.00020694,'(I)C30H47N3O14-'
802.19,8.23E-05,'(I)C29H45N3O15-'
802.226,1.09E-05,'(I)C30H49N3O14-'
803.072,1.48E-05,'(I)C20H32N6O20-'
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804.169,3.35E-05,'(I)C28H43N3O16-'
804.206,1.16E-05,'(I)C29H47N3O15-'
805.165,0.000144977,'(I)C27H42N4O16-'
807.144,0.000122807,'(I)C26H40N4O17-'
807.18,9.64E-05,'(I)C27H44N4O16-'
809.16,9.83E-05,'(I)C26H42N4O17-'
812.174,4.88E-05,'(I)C30H43N3O15-'
814.19,6.69E-05,'(I)C30H45N3O15-'
816.169,1.42E-05,'(I)C29H43N3O16-'
816.206,0.000110688,'(I)C30H47N3O15-'
818.185,3.85E-05,'(I)C29H45N3O16-'
818.221,1.10E-05,'(I)C30H49N3O15-'
819.144,0.000186258,'(I)C27H40N4O17-'
821.16,0.0002499,'(I)C27H42N4O17-'
823.175,0.000142266,'(I)C27H44N4O17-'
829.201,3.09E-05,'(I)C30H46N4O15-'
830.185,3.31E-05,'(I)C30H45N3O16-'
832.201,6.04E-05,'(I)C30H47N3O16-'
833.196,3.93E-05,'(I)C29H46N4O16-'
834.18,2.81E-05,'(I)C29H45N3O17-'
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837.154,0.000126345,'(I)C27H42N4O18-'
839.17,5.29E-05,'(I)C27H44N4O18-'
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847.212,0.00189223,'(I)C30H48N4O16-'
848.196,6.92E-05,'(I)C30H47N3O17-'
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851.17,0.000157245,'(I)C28H44N4O18-'
861.191,0.000177879,'(I)C30H46N4O17-'
863.206,0.00068885,'(I)C30H48N4O17-'
865.186,0.000240581,'(I)C29H46N4O18-'
866.145,0.000130385,'(I)C27H41N5O19-'
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875.17,5.56E-05,'(I)C30H44N4O18-'
877.186,0.000159851,'(I)C30H46N4O18-'
879.201,0.000325478,'(I)C30H48N4O18-'
881.181,9.81E-05,'(I)C29H46N4O19-'
891.165,2.33E-05,'(I)C30H44N4O19-'
892.197,3.40E-05,'(I)C30H47N5O18-'
893.181,8.39E-05,'(I)C30H46N4O19-'
894.176,4.38E-05,'(I)C29H45N5O19-'
894.212,1.98E-05,'(I)C30H49N5O18-'
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896.192,2.67E-05,'(I)C29H47N5O19-'
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908.192,0.000128591,'(I)C30H47N5O19-'
909.176,2.42E-05,'(I)C30H46N4O20-'
910.171,0.000202941,'(I)C29H45N5O20-'
911.191,3.30E-05,'(I)C30H48N4O20-'
922.171,0.000134042,'(I)C30H45N5O20-'
924.186,0.000191587,'(I)C30H47N5O20-'
926.202,4.62E-05,'(I)C30H49N5O20-'
927.15,1.74E-05,'(I)C29H44N4O22-'
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938.166,2.92E-05,'(I)C30H45N5O21-'
939.197,1.49E-05,'(I)C30H48N6O20-'
940.181,7.26E-05,'(I)C30H47N5O21-'
940.331,5.14E-06,'(I)C39H63N3O15-'
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942.197,3.32E-05,'(I)C30H49N5O21-'
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953.177,2.35E-05,'(I)C30H46N6O21-'
956.176,1.67E-05,'(I)C30H47N5O22-'
958.192,1.68E-05,'(I)C30H49N5O22-'
959.14,9.37E-06,'(I)C29H44N4O24-'
960.208,8.50E-06,'(I)C30H51N5O22-'
969.172,0.000108085,'(I)C30H46N6O22-'
971.14,5.89E-06,'(I)C30H44N4O24-'
971.187,9.12E-06,'(I)C30H48N6O22-'
983.337,8.63E-07,'(I)C40H64N4O16-'
999.332,1.78E-06,'(I)C40H64N4O17-'
1003.18,1.62E-05,'(I)C30H48N6O24-'
1005.19,1.51E-05,'(I)C30H50N6O24-'
1007.21,5.88E-06,'(I)C30H52N6O24-'
1013.31,1.25E-06,'(I)C40H62N4O18-'
1015.33,1.21E-06,'(I)C40H64N4O18-'
1036.25,2.84E-06,'(I)C40H55N5O19-'
1076.27,9.21E-07,'(I)C39H59N5O22-'
