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Name
Formula / Structure
ExactMass
ID
7-ACETOXY-6-METHYLCOUMARIN
1 spectrum
C12H10O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
218.05791
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP001139
7-ACETOXY-8,11-EPOXY-11-EPI-SINULARIOLIDE
1 spectrum
C22H32O6
392.21988
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP010669
7-ACETOXYCOUMARIN
1 spectrum
C11H8O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
204.04227
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP001159
7-ACETOXYFLAVANONE
1 spectrum
C17H14O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
282.08920
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP000636
7-ACETYL-4-UMBELLIFERONE
1 spectrum
C12H10O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
218.05791
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP005266
7-Acetyllycopsamine
20 spectra
C17H27NO6
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
341.18381
LC-ESI-ITFT; MS2; CE: 10%; R=15000; [M+H]+
MSBNK-NaToxAq-NA002359
LC-ESI-ITFT; MS2; CE: 100%; R=15000; [M+H]+
MSBNK-NaToxAq-NA003502
LC-ESI-ITFT; MS2; CE: 105%; R=15000; [M+H]+
MSBNK-NaToxAq-NA003503
LC-ESI-ITFT; MS2; CE: 15%; R=15000; [M+H]+
MSBNK-NaToxAq-NA002360
LC-ESI-ITFT; MS2; CE: 20%; R=15000; [M+H]+
MSBNK-NaToxAq-NA002361
LC-ESI-ITFT; MS2; CE: 25%; R=15000; [M+H]+
MSBNK-NaToxAq-NA002362
LC-ESI-ITFT; MS2; CE: 30%; R=15000; [M+H]+
MSBNK-NaToxAq-NA002363
LC-ESI-ITFT; MS2; CE: 35%; R=15000; [M+H]+
MSBNK-NaToxAq-NA002754
LC-ESI-ITFT; MS2; CE: 40%; R=15000; [M+H]+
MSBNK-NaToxAq-NA002755
LC-ESI-ITFT; MS2; CE: 45%; R=15000; [M+H]+
MSBNK-NaToxAq-NA002756
LC-ESI-ITFT; MS2; CE: 50%; R=15000; [M+H]+
MSBNK-NaToxAq-NA002757
LC-ESI-ITFT; MS2; CE: 55%; R=15000; [M+H]+
MSBNK-NaToxAq-NA002758
LC-ESI-ITFT; MS2; CE: 60%; R=15000; [M+H]+
MSBNK-NaToxAq-NA003134
LC-ESI-ITFT; MS2; CE: 65%; R=15000; [M+H]+
MSBNK-NaToxAq-NA003135
LC-ESI-ITFT; MS2; CE: 70%; R=15000; [M+H]+
MSBNK-NaToxAq-NA003136
LC-ESI-ITFT; MS2; CE: 75%; R=15000; [M+H]+
MSBNK-NaToxAq-NA003137
LC-ESI-ITFT; MS2; CE: 80%; R=15000; [M+H]+
MSBNK-NaToxAq-NA003138
LC-ESI-ITFT; MS2; CE: 85%; R=15000; [M+H]+
MSBNK-NaToxAq-NA003499
LC-ESI-ITFT; MS2; CE: 90%; R=15000; [M+H]+
MSBNK-NaToxAq-NA003500
LC-ESI-ITFT; MS2; CE: 95%; R=15000; [M+H]+
MSBNK-NaToxAq-NA003501
7-acetyloxy-2-(3,4-diacetyloxyphenyl)-4-oxochromen...
5 spectra
C23H18O10
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
454.09000
LC-APCI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80582
LC-ESI-QTOF; MS2; CE 10 ev; [M+H]+
MSBNK-Washington_State_Univ-BML00106
LC-ESI-QTOF; MS2; CE 20 ev; [M+H]+
MSBNK-Washington_State_Univ-BML00118
LC-ESI-QTOF; MS2; CE 40 ev; [M+H]+
MSBNK-Washington_State_Univ-BML00130
LC-ESI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80580
7-AMINO-2,4,6-TRIMETHYLQUINOLINE
1 spectrum
C12H14N2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
186.11571
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP005657
7-Amino-4-hydroxynaphthalene-2-sulfonic acid
3 spectra
C10H9NO4S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
239.02522
ESI-QTOF; MS2; CE: 10; [M-H]-
MSBNK-EPA-ENTACT_AGILENT002425
ESI-QTOF; MS2; CE: 20; [M-H]-
MSBNK-EPA-ENTACT_AGILENT002423
ESI-QTOF; MS2; CE: 40; [M-H]-
MSBNK-EPA-ENTACT_AGILENT002424
7-Amino-4-methylcoumarin
23 spectra
C10H9NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
175.06332
LC-ESI-ITFT; MS2; CE: 10%; R=15000; [M+H]+
MSBNK-UFZ-WANA243101AD6CPH
LC-ESI-ITFT; MS2; CE: 20%; R=15000; [M+H]+
MSBNK-UFZ-WANA243103B085PH
LC-ESI-ITFT; MS2; CE: 30%; R=15000; [M+H]+
MSBNK-UFZ-WANA243105070APH
LC-ESI-ITFT; MS2; CE: 40%; R=15000; [M+H]+
MSBNK-UFZ-WANA243111C9CFPH
LC-ESI-ITFT; MS2; CE: 50%; R=15000; [M+H]+
MSBNK-UFZ-WANA243113D9F1PH
LC-ESI-ITFT; MS2; CE: 60%; R=15000; [M+H]+
MSBNK-UFZ-WANA2431155BE0PH
LC-ESI-ITFT; MS2; CE: 70%; R=15000; [M+H]+
MSBNK-UFZ-WANA2431213166PH
LC-ESI-ITFT; MS2; CE: 80%; R=15000; [M+H]+
MSBNK-UFZ-WANA2431237762PH
LC-ESI-ITFT; MS2; CE: 90%; R=15000; [M+H]+
MSBNK-UFZ-WANA243125AF82PH
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM884001
LC-ESI-QTOF; MS2; 10 V
MSBNK-BAFG-CSL23111027764
LC-ESI-QTOF; MS2; 20 V
MSBNK-BAFG-CSL23111027765
LC-ESI-QTOF; MS2; 30 V
MSBNK-BAFG-CSL23111027766
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111027767
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111027772
LC-ESI-QTOF; MS2; 50 V
MSBNK-BAFG-CSL23111027768
LC-ESI-QTOF; MS2; 60 V
MSBNK-BAFG-CSL23111027769
LC-ESI-QTOF; MS2; 70 V
MSBNK-BAFG-CSL23111027770
LC-ESI-QTOF; MS2; 80 V
MSBNK-BAFG-CSL23111027771
LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU248201
LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU248202
LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU248203
LC-ESI-QTOF; MS2; CE: Ramp 17.1-25.7 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU248206
7-amino-8-(2,4-dihydroxy-6-methylphenyl)-1,9-dimet...
7 spectra
C21H18N2O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
362.12665
LC-APCI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80588
LC-APCI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80587
LC-ESI-QTOF; MS2; CE 10 ev; [M+H]+
MSBNK-Washington_State_Univ-BML00746
LC-ESI-QTOF; MS2; CE 20 ev; [M+H]+
MSBNK-Washington_State_Univ-BML00753
LC-ESI-QTOF; MS2; CE 40 ev; [M+H]+
MSBNK-Washington_State_Univ-BML00760
LC-ESI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80586
LC-ESI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80585
7-amino-flunitrazepam
13 spectra
C16H14FN3O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
283.11209
LC-ESI-QFT; MS2; CE: 120; R=35000; [M+H]+
MSBNK-Eawag-EQ371907
LC-ESI-QFT; MS2; CE: 150; R=35000; [M+H]+
MSBNK-Eawag-EQ371908
LC-ESI-QFT; MS2; CE: 15; R=35000; [M+H]+
MSBNK-Eawag-EQ371901
LC-ESI-QFT; MS2; CE: 180; R=35000; [M+H]+
MSBNK-Eawag-EQ371909
LC-ESI-QFT; MS2; CE: 30; R=35000; [M+H]+
MSBNK-Eawag-EQ371902
LC-ESI-QFT; MS2; CE: 45; R=35000; [M+H]+
MSBNK-Eawag-EQ371903
LC-ESI-QFT; MS2; CE: 60; R=35000; [M+H]+
MSBNK-Eawag-EQ371904
LC-ESI-QFT; MS2; CE: 75; R=35000; [M+H]+
MSBNK-Eawag-EQ371905
LC-ESI-QFT; MS2; CE: 90; R=35000; [M+H]+
MSBNK-Eawag-EQ371906
LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU159602
LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU159603
LC-ESI-QTOF; MS2; CE: 40 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU159604
LC-ESI-QTOF; MS2; CE: 50 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU159605
7-Aminoclonazepam
6 spectra
C15H12ClN3O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
285.06689
LC-ESI-Q; MS; POS; 15 V
MSBNK-Waters-WA002852
LC-ESI-Q; MS; POS; 30 V
MSBNK-Waters-WA002851
LC-ESI-Q; MS; POS; 45 V
MSBNK-Waters-WA002850
LC-ESI-Q; MS; POS; 60 V
MSBNK-Waters-WA002849
LC-ESI-Q; MS; POS; 75 V
MSBNK-Waters-WA002848
LC-ESI-Q; MS; POS; 90 V
MSBNK-Waters-WA002847
7-Aminoflunitrazepam
6 spectra
C16H14FN3O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
283.11209
LC-ESI-Q; MS; POS; 15 V
MSBNK-Waters-WA002846
LC-ESI-Q; MS; POS; 30 V
MSBNK-Waters-WA002845
LC-ESI-Q; MS; POS; 45 V
MSBNK-Waters-WA002844
LC-ESI-Q; MS; POS; 60 V
MSBNK-Waters-WA002843
LC-ESI-Q; MS; POS; 75 V
MSBNK-Waters-WA002842
LC-ESI-Q; MS; POS; 90 V
MSBNK-Waters-WA002841
7-Aminonitrazepam
5 spectra
C15H13N3O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
251.10587
LC-ESI-Q; MS; POS; 15 V
MSBNK-Waters-WA002840
LC-ESI-Q; MS; POS; 30 V
MSBNK-Waters-WA002839
LC-ESI-Q; MS; POS; 45 V
MSBNK-Waters-WA002838
LC-ESI-Q; MS; POS; 60 V
MSBNK-Waters-WA002837
LC-ESI-Q; MS; POS; 75 V, 90 V
MSBNK-Waters-WA002836
7-BENZOYLNEOBAVAISOFLAVONE
1 spectrum
C27H22O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
426.14673
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP001120
7-BENZYLOXY-2',3'-DIHYDRO-2',2'-DIMETHYL-O,6'-BI(4...
1 spectrum
C27H24O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
412.16745
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP001122
7-Benzyloxygramine
2 spectra
C18H20N2O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
280.15756
LC-ESI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80591
LC-ESI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80590
7-Benzyloxytryptamine
6 spectra
C17H18N2O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
266.14191
LC-APCI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80597
LC-ESI-QTOF; MS2; CE 10 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01380
LC-ESI-QTOF; MS2; CE 20 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01389
LC-ESI-QTOF; MS2; CE 40 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01398
LC-ESI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80596
LC-ESI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80595
7-BROMO-3-METHOXY-2-METHYLTHIOISOQUINOLINE
2 spectra
C11H10BrNOS
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
282.96664
CI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP007940
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP007938
7-BUTYL-6,6-DIMETHYLBICYCLO(3.3.0)OCT-7-EN-2-ONE
1 spectrum
C14H22O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
206.16707
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP004885
7-CHLOR0-4-HYDROXYBENZOPYLIMIDINE
1 spectrum
C8H5ClN2O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
180.00903
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP008259
7-CHLORO-1,3-DIHYDRO-3-HYDROXY-5-PHENYL-2H-1,4-BEN...
1 spectrum
C15H11ClN2O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
286.05090
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP002811
7-CHLORO-2,5-DIMETHYL-1,2,3,4-TETRAHYDROPYRIMIDO(1...
1 spectrum
C13H15ClN2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
234.09238
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP004402
7-chloro-4-methyl-2-oxochromen-6-yl propanoate
5 spectra
C13H11ClO4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
266.03458
LC-APCI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80602
LC-ESI-QTOF; MS2; CE 10 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01382
LC-ESI-QTOF; MS2; CE 20 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01391
LC-ESI-QTOF; MS2; CE 40 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01400
LC-ESI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80600
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