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Name
Formula / Structure
ExactMass
ID
Jacobine
56 spectra
C18H25NO6
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
351.16821
LC-ESI-ITFT; MS2; CE: 10%; R=15000; [M+H]+
NA000431
LC-ESI-ITFT; MS2; CE: 10%; R=15000; [M+H]+
NA002270
LC-ESI-ITFT; MS2; CE: 100%; R=15000; [M+H]+
NA000722
LC-ESI-ITFT; MS2; CE: 100%; R=15000; [M+H]+
NA003417
LC-ESI-ITFT; MS2; CE: 105%; R=15000; [M+H]+
NA003418
LC-ESI-ITFT; MS2; CE: 110%; R=15000; [M+H]+
NA000724
LC-ESI-ITFT; MS2; CE: 15%; R=15000; [M+H]+
NA000432
LC-ESI-ITFT; MS2; CE: 15%; R=15000; [M+H]+
NA000481
LC-ESI-ITFT; MS2; CE: 15%; R=15000; [M+H]+
NA002271
LC-ESI-ITFT; MS2; CE: 20%; R=15000; [M+H]+
NA000433
LC-ESI-ITFT; MS2; CE: 20%; R=15000; [M+H]+
NA000482
LC-ESI-ITFT; MS2; CE: 20%; R=15000; [M+H]+
NA002272
LC-ESI-ITFT; MS2; CE: 25%; R=15000; [M+H]+
NA000434
LC-ESI-ITFT; MS2; CE: 25%; R=15000; [M+H]+
NA000483
LC-ESI-ITFT; MS2; CE: 25%; R=15000; [M+H]+
NA002273
LC-ESI-ITFT; MS2; CE: 30%; R=15000; [M+H]+
NA000435
LC-ESI-ITFT; MS2; CE: 30%; R=15000; [M+H]+
NA000484
LC-ESI-ITFT; MS2; CE: 30%; R=15000; [M+H]+
NA002274
LC-ESI-ITFT; MS2; CE: 35%; R=15000; [M+H]+
NA000485
LC-ESI-ITFT; MS2; CE: 35%; R=15000; [M+H]+
NA000532
LC-ESI-ITFT; MS2; CE: 35%; R=15000; [M+H]+
NA002667
LC-ESI-ITFT; MS2; CE: 40%; R=15000; [M+H]+
NA000531
LC-ESI-ITFT; MS2; CE: 40%; R=15000; [M+H]+
NA000582
LC-ESI-ITFT; MS2; CE: 40%; R=15000; [M+H]+
NA002668
LC-ESI-ITFT; MS2; CE: 45%; R=15000; [M+H]+
NA000534
LC-ESI-ITFT; MS2; CE: 45%; R=15000; [M+H]+
NA000581
LC-ESI-ITFT; MS2; CE: 45%; R=15000; [M+H]+
NA002669
LC-ESI-ITFT; MS2; CE: 50%; R=15000; [M+H]+
NA000533
LC-ESI-ITFT; MS2; CE: 50%; R=15000; [M+H]+
NA000584
LC-ESI-ITFT; MS2; CE: 50%; R=15000; [M+H]+
NA002670
LC-ESI-ITFT; MS2; CE: 55%; R=15000; [M+H]+
NA000583
LC-ESI-ITFT; MS2; CE: 55%; R=15000; [M+H]+
NA000632
LC-ESI-ITFT; MS2; CE: 55%; R=15000; [M+H]+
NA002671
LC-ESI-ITFT; MS2; CE: 60%; R=15000; [M+H]+
NA000535
LC-ESI-ITFT; MS2; CE: 60%; R=15000; [M+H]+
NA000678
LC-ESI-ITFT; MS2; CE: 60%; R=15000; [M+H]+
NA003049
LC-ESI-ITFT; MS2; CE: 65%; R=15000; [M+H]+
NA000585
LC-ESI-ITFT; MS2; CE: 65%; R=15000; [M+H]+
NA000634
LC-ESI-ITFT; MS2; CE: 65%; R=15000; [M+H]+
NA003050
LC-ESI-ITFT; MS2; CE: 70%; R=15000; [M+H]+
NA000631
LC-ESI-ITFT; MS2; CE: 70%; R=15000; [M+H]+
NA000680
LC-ESI-ITFT; MS2; CE: 70%; R=15000; [M+H]+
NA003051
LC-ESI-ITFT; MS2; CE: 75%; R=15000; [M+H]+
NA000677
LC-ESI-ITFT; MS2; CE: 75%; R=15000; [M+H]+
NA000723
LC-ESI-ITFT; MS2; CE: 75%; R=15000; [M+H]+
NA003052
LC-ESI-ITFT; MS2; CE: 80%; R=15000; [M+H]+
NA000633
LC-ESI-ITFT; MS2; CE: 80%; R=15000; [M+H]+
NA000759
LC-ESI-ITFT; MS2; CE: 80%; R=15000; [M+H]+
NA003053
LC-ESI-ITFT; MS2; CE: 85%; R=15000; [M+H]+
NA000679
LC-ESI-ITFT; MS2; CE: 85%; R=15000; [M+H]+
NA000725
LC-ESI-ITFT; MS2; CE: 85%; R=15000; [M+H]+
NA003414
LC-ESI-ITFT; MS2; CE: 90%; R=15000; [M+H]+
NA000635
LC-ESI-ITFT; MS2; CE: 90%; R=15000; [M+H]+
NA000760
LC-ESI-ITFT; MS2; CE: 90%; R=15000; [M+H]+
NA003415
LC-ESI-ITFT; MS2; CE: 95%; R=15000; [M+H]+
NA000681
LC-ESI-ITFT; MS2; CE: 95%; R=15000; [M+H]+
NA003416
Jacobine N-oxide
58 spectra
C18H25NO7
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
367.16309
LC-ESI-ITFT; MS2; CE: 10%; R=15000; [M+H]+
NA000451
LC-ESI-ITFT; MS2; CE: 10%; R=15000; [M+H]+
NA002285
LC-ESI-ITFT; MS2; CE: 100%; R=15000; [M+H]+
NA000738
LC-ESI-ITFT; MS2; CE: 100%; R=15000; [M+H]+
NA003432
LC-ESI-ITFT; MS2; CE: 105%; R=15000; [M+H]+
NA000772
LC-ESI-ITFT; MS2; CE: 105%; R=15000; [M+H]+
NA003433
LC-ESI-ITFT; MS2; CE: 110%; R=15000; [M+H]+
NA000740
LC-ESI-ITFT; MS2; CE: 120%; R=15000; [M+H]+
NA000742
LC-ESI-ITFT; MS2; CE: 15%; R=15000; [M+H]+
NA000452
LC-ESI-ITFT; MS2; CE: 15%; R=15000; [M+H]+
NA000501
LC-ESI-ITFT; MS2; CE: 15%; R=15000; [M+H]+
NA002286
LC-ESI-ITFT; MS2; CE: 20%; R=15000; [M+H]+
NA000453
LC-ESI-ITFT; MS2; CE: 20%; R=15000; [M+H]+
NA000502
LC-ESI-ITFT; MS2; CE: 20%; R=15000; [M+H]+
NA002287
LC-ESI-ITFT; MS2; CE: 25%; R=15000; [M+H]+
NA000454
LC-ESI-ITFT; MS2; CE: 25%; R=15000; [M+H]+
NA000503
LC-ESI-ITFT; MS2; CE: 25%; R=15000; [M+H]+
NA002288
LC-ESI-ITFT; MS2; CE: 30%; R=15000; [M+H]+
NA000455
LC-ESI-ITFT; MS2; CE: 30%; R=15000; [M+H]+
NA000504
LC-ESI-ITFT; MS2; CE: 30%; R=15000; [M+H]+
NA002289
LC-ESI-ITFT; MS2; CE: 35%; R=15000; [M+H]+
NA000505
LC-ESI-ITFT; MS2; CE: 35%; R=15000; [M+H]+
NA000552
LC-ESI-ITFT; MS2; CE: 35%; R=15000; [M+H]+
NA002682
LC-ESI-ITFT; MS2; CE: 40%; R=15000; [M+H]+
NA000551
LC-ESI-ITFT; MS2; CE: 40%; R=15000; [M+H]+
NA000602
LC-ESI-ITFT; MS2; CE: 40%; R=15000; [M+H]+
NA002683
LC-ESI-ITFT; MS2; CE: 45%; R=15000; [M+H]+
NA000554
LC-ESI-ITFT; MS2; CE: 45%; R=15000; [M+H]+
NA000601
LC-ESI-ITFT; MS2; CE: 45%; R=15000; [M+H]+
NA002684
LC-ESI-ITFT; MS2; CE: 50%; R=15000; [M+H]+
NA000553
LC-ESI-ITFT; MS2; CE: 50%; R=15000; [M+H]+
NA000604
LC-ESI-ITFT; MS2; CE: 50%; R=15000; [M+H]+
NA002685
LC-ESI-ITFT; MS2; CE: 55%; R=15000; [M+H]+
NA000603
LC-ESI-ITFT; MS2; CE: 55%; R=15000; [M+H]+
NA000650
LC-ESI-ITFT; MS2; CE: 55%; R=15000; [M+H]+
NA002686
LC-ESI-ITFT; MS2; CE: 60%; R=15000; [M+H]+
NA000555
LC-ESI-ITFT; MS2; CE: 60%; R=15000; [M+H]+
NA000698
LC-ESI-ITFT; MS2; CE: 60%; R=15000; [M+H]+
NA003064
LC-ESI-ITFT; MS2; CE: 65%; R=15000; [M+H]+
NA000605
LC-ESI-ITFT; MS2; CE: 65%; R=15000; [M+H]+
NA000652
LC-ESI-ITFT; MS2; CE: 65%; R=15000; [M+H]+
NA003065
LC-ESI-ITFT; MS2; CE: 70%; R=15000; [M+H]+
NA000649
LC-ESI-ITFT; MS2; CE: 70%; R=15000; [M+H]+
NA000700
LC-ESI-ITFT; MS2; CE: 70%; R=15000; [M+H]+
NA003066
LC-ESI-ITFT; MS2; CE: 75%; R=15000; [M+H]+
NA000697
LC-ESI-ITFT; MS2; CE: 75%; R=15000; [M+H]+
NA000739
LC-ESI-ITFT; MS2; CE: 75%; R=15000; [M+H]+
NA003067
LC-ESI-ITFT; MS2; CE: 80%; R=15000; [M+H]+
NA000651
LC-ESI-ITFT; MS2; CE: 80%; R=15000; [M+H]+
NA000773
LC-ESI-ITFT; MS2; CE: 80%; R=15000; [M+H]+
NA003068
LC-ESI-ITFT; MS2; CE: 85%; R=15000; [M+H]+
NA000699
LC-ESI-ITFT; MS2; CE: 85%; R=15000; [M+H]+
NA000741
LC-ESI-ITFT; MS2; CE: 85%; R=15000; [M+H]+
NA003429
LC-ESI-ITFT; MS2; CE: 90%; R=15000; [M+H]+
NA000653
LC-ESI-ITFT; MS2; CE: 90%; R=15000; [M+H]+
NA000774
LC-ESI-ITFT; MS2; CE: 90%; R=15000; [M+H]+
NA003430
LC-ESI-ITFT; MS2; CE: 95%; R=15000; [M+H]+
NA000701
LC-ESI-ITFT; MS2; CE: 95%; R=15000; [M+H]+
NA003431
JASMONE
1 spectrum
C11H16O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
164.12012
EI-B; MS
JP007721
Jasmonic acid
6 spectra
C12H18O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
210.12560
LC-APCI-QTOF; MS; NEGATIVE
BML81493
LC-APCI-QTOF; MS; POSITIVE
BML81492
LC-ESI-QTOF; MS2; CE 10 ev; [M+H]+
BML00646
LC-ESI-QTOF; MS2; CE 10 ev; [M-H]-
BML00677
LC-ESI-QTOF; MS; NEGATIVE
BML81491
LC-ESI-QTOF; MS; POSITIVE
BML81490
Jasmonic acid methyl ester, 3-Oxo-2-(2-pentenyl)cy...
3 spectra
C13H20O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
224.30000
LC-ESI-QQ; MS2
PS070101
LC-ESI-QQ; MS2
PS070102
LC-ESI-QQ; MS2
PS070103
Jervine
20 spectra
C27H39NO3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
425.29300
LC-ESI-ITFT; MS2; CE: 10%; R=15000; [M+H]+
NA002561
LC-ESI-ITFT; MS2; CE: 100%; R=15000; [M+H]+
NA003702
LC-ESI-ITFT; MS2; CE: 105%; R=15000; [M+H]+
NA003703
LC-ESI-ITFT; MS2; CE: 15%; R=15000; [M+H]+
NA002562
LC-ESI-ITFT; MS2; CE: 20%; R=15000; [M+H]+
NA002563
LC-ESI-ITFT; MS2; CE: 25%; R=15000; [M+H]+
NA002564
LC-ESI-ITFT; MS2; CE: 30%; R=15000; [M+H]+
NA002565
LC-ESI-ITFT; MS2; CE: 35%; R=15000; [M+H]+
NA002954
LC-ESI-ITFT; MS2; CE: 40%; R=15000; [M+H]+
NA002955
LC-ESI-ITFT; MS2; CE: 45%; R=15000; [M+H]+
NA002956
LC-ESI-ITFT; MS2; CE: 50%; R=15000; [M+H]+
NA002957
LC-ESI-ITFT; MS2; CE: 55%; R=15000; [M+H]+
NA002958
LC-ESI-ITFT; MS2; CE: 60%; R=15000; [M+H]+
NA003329
LC-ESI-ITFT; MS2; CE: 65%; R=15000; [M+H]+
NA003330
LC-ESI-ITFT; MS2; CE: 70%; R=15000; [M+H]+
NA003331
LC-ESI-ITFT; MS2; CE: 75%; R=15000; [M+H]+
NA003332
LC-ESI-ITFT; MS2; CE: 80%; R=15000; [M+H]+
NA003333
LC-ESI-ITFT; MS2; CE: 85%; R=15000; [M+H]+
NA003699
LC-ESI-ITFT; MS2; CE: 90%; R=15000; [M+H]+
NA003700
LC-ESI-ITFT; MS2; CE: 95%; R=15000; [M+H]+
NA003701
Josamycin
4 spectra
C42H69NO15
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
827.46674
LC-APCI-QTOF; MS; NEGATIVE
BML81498
LC-APCI-QTOF; MS; POSITIVE
BML81497
LC-ESI-QTOF; MS; NEGATIVE
BML81496
LC-ESI-QTOF; MS; POSITIVE
BML81495
JSTX-3
2 spectra
C27H47N7O6
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
565.35876
MALDI-TOFTOF; MS2; CE: 20kV; [M+K]+
JEL00016
MALDI-TOFTOF; MS2; CE: 20kV; [M+Na]+
JEL00015
Juglanin
2 spectra
C20H18O10
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
418.09000
LC-ESI-ITTOF; MS; [M+H]+
TY000222
LC-ESI-ITTOF; MS; [M-H]-
TY000223
Jusmicranthin ethyl ether
13 spectra
C22H16O7
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
392.36301
LC-ESI-QTOF; MS2
PR303946
LC-ESI-QTOF; MS2
PR303947
LC-ESI-QTOF; MS2
PR303948
LC-ESI-QTOF; MS2
PR303949
LC-ESI-QTOF; MS2
PR303950
LC-ESI-QTOF; MS2
PR303951
LC-ESI-QTOF; MS2
PR303952
LC-ESI-QTOF; MS2
PR303953
LC-ESI-QTOF; MS2
PR303954
LC-ESI-QTOF; MS2
PR303955
LC-ESI-QTOF; MS2
PR303956
LC-ESI-QTOF; MS2
PR303957
LC-ESI-QTOF; MS2
PR310444
Justicidin B
5 spectra
C21H16O6
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
364.09470
LC-APCI-QTOF; MS; POSITIVE
BML81502
LC-ESI-QTOF; MS2; CE 10 ev; [M+H]+
BML01595
LC-ESI-QTOF; MS2; CE 20 ev; [M+H]+
BML01604
LC-ESI-QTOF; MS2; CE 40 ev; [M+H]+
BML01613
LC-ESI-QTOF; MS; POSITIVE
BML81500
Justicidin G
13 spectra
C21H14O7
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
378.33600
LC-ESI-QTOF; MS2
PR303958
LC-ESI-QTOF; MS2
PR303959
LC-ESI-QTOF; MS2
PR303960
LC-ESI-QTOF; MS2
PR303961
LC-ESI-QTOF; MS2
PR303962
LC-ESI-QTOF; MS2
PR303963
LC-ESI-QTOF; MS2
PR303964
LC-ESI-QTOF; MS2
PR303965
LC-ESI-QTOF; MS2
PR303966
LC-ESI-QTOF; MS2
PR303967
LC-ESI-QTOF; MS2
PR303968
LC-ESI-QTOF; MS2
PR303969
LC-ESI-QTOF; MS2
PR310443
JWH-018
15 spectra
C24H23NO
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
341.17798
LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M+H]+
AU170601
LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M+Na]+
AU170630
LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M+H]+
AU170602
LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M+Na]+
AU170631
LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M+H]+
AU170603
LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M+Na]+
AU170632
LC-ESI-QTOF; MS2; CE: 40 eV; R=35000; [M+H]+
AU170604
LC-ESI-QTOF; MS2; CE: 40 eV; R=35000; [M+Na]+
AU170633
LC-ESI-QTOF; MS2; CE: 50 eV; R=35000; [M+H]+
AU170605
LC-ESI-QTOF; MS2; CE: 50 eV; R=35000; [M+Na]+
AU170634
LC-ESI-QTOF; MS2; HILIC; CE: 10 eV; R=35000; [M+H]+
AU170607
LC-ESI-QTOF; MS2; HILIC; CE: 20 eV; R=35000; [M+H]+
AU170608
LC-ESI-QTOF; MS2; HILIC; CE: 30 eV; R=35000; [M+H]+
AU170609
LC-ESI-QTOF; MS2; HILIC; CE: 40 eV; R=35000; [M+H]+
AU170610
LC-ESI-QTOF; MS2; HILIC; CE: 50 eV; R=35000; [M+H]+
AU170611
JWH-073
12 spectra
C23H21NO
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
327.16232
LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M+H]+
AU170401
LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M+Na]+
AU170430
LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M+H]+
AU170402
LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M+Na]+
AU170431
LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M+H]+
AU170403
LC-ESI-QTOF; MS2; CE: 40 eV; R=35000; [M+H]+
AU170404
LC-ESI-QTOF; MS2; CE: 50 eV; R=35000; [M+H]+
AU170405
LC-ESI-QTOF; MS2; HILIC; CE: 10 eV; R=35000; [M+H]+
AU170407
LC-ESI-QTOF; MS2; HILIC; CE: 20 eV; R=35000; [M+H]+
AU170408
LC-ESI-QTOF; MS2; HILIC; CE: 30 eV; R=35000; [M+H]+
AU170409
LC-ESI-QTOF; MS2; HILIC; CE: 40 eV; R=35000; [M+H]+
AU170410
LC-ESI-QTOF; MS2; HILIC; CE: 50 eV; R=35000; [M+H]+
AU170411
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