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Name
Formula / Structure
ExactMass
ID
5,5-DIMETHYL-6-METHYLENEBICYCLO(2.2.1)HEPTAN-2-OL
1 spectrum
C10H16O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
152.12012
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP010924
5,5-Dimethylbarbituric acid
6 spectra
C6H8N2O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
156.05350
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
MSBNK-LCSB-LU024951
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
MSBNK-LCSB-LU024952
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
MSBNK-LCSB-LU024953
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
MSBNK-LCSB-LU024954
LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
MSBNK-LCSB-LU024955
LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
MSBNK-LCSB-LU024956
5,5-DIMETHYLHEXAN-2,4-DIONE
1 spectrum
C8H14O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
142.09938
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP004747
5,5-Dimethylhydantoin
5 spectra
C5H8N2O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
128.05858
ESI-QTOF; MS2; CE: 10; [M-H]-
MSBNK-EPA-ENTACT_AGILENT000809
ESI-QTOF; MS2; CE: 20; [M-H]-
MSBNK-EPA-ENTACT_AGILENT000810
ESI-QTOF; MS2; CE: 40; [M-H]-
MSBNK-EPA-ENTACT_AGILENT000808
LC-ESI-QTOF; MS2; 10 V
MSBNK-BAFG-CSL2311109232
LC-ESI-QTOF; MS2; 20 V
MSBNK-BAFG-CSL2311109233
5,5-DIPHENYL-IMIDAZOLIDINE-2,4-DIONE
1 spectrum
C15H12N2O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
252.08987
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP002791
5,6,7,14,15,16-HEXAHYDRO-6,15-METHANOBENZO(A)NAPHT...
1 spectrum
C23H22
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
298.17215
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP011519
5,6,7,8-TETRAHYDROISOQUINOLINE
1 spectrum
C9H11N
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
133.08916
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP000489
5,6-BENZO-1,1,4,4-TETRAETHYL-1,4-DISILACYCLOHEX-5-...
1 spectrum
C16H28Si2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
276.17294
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP011945
5,6-BENZO-2-TETRACARBONYLIRON-1,1,3,3-TETRAETHYLDI...
1 spectrum
C18H24FeO4Si2
416.05624
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP011754
5,6-Benzoflavone
9 spectra
C19H12O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
272.08374
ESI-QTOF; MS2; CE: 10; [M+H]+
MSBNK-EPA-ENTACT_AGILENT002398
ESI-QTOF; MS2; CE: 20; [M+H]+
MSBNK-EPA-ENTACT_AGILENT002396
ESI-QTOF; MS2; CE: 40; [M+H]+
MSBNK-EPA-ENTACT_AGILENT002397
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
MSBNK-LCSB-LU117901
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
MSBNK-LCSB-LU117902
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
MSBNK-LCSB-LU117903
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
MSBNK-LCSB-LU117904
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
MSBNK-LCSB-LU117905
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
MSBNK-LCSB-LU117906
5,6-Chrysenequinone
2 spectra
C18H10O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
258.06812
APCI-ITFT; MS2; CE: 35%; R=30000; [M+H]+
MSBNK-UFZ-UA002203
ESI-ITFT; MS2; CE: 35%; R=30000; [M+H]+
MSBNK-UFZ-UA002201
5,6-DiHETE
6 spectra
C20H32O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
336.23007
LC-ESI-QFT; MS2; CE: 20.0; R=30.000; [M-H]-
MSBNK-ISAS_Dortmund-IA000058
LC-ESI-QFT; MS2; CE: 30.0; R=30.000; [M-H]-
MSBNK-ISAS_Dortmund-IA000059
LC-ESI-QFT; MS2; CE: 40.0; R=30.000; [M-H]-
MSBNK-ISAS_Dortmund-IA000060
LC-ESI-QTOF; MS2; CE: 10.0; R=N/A; [M-H]-
MSBNK-ISAS_Dortmund-IA000427
LC-ESI-QTOF; MS2; CE: 20.0; R=N/A; [M-H]-
MSBNK-ISAS_Dortmund-IA000428
LC-ESI-QTOF; MS2; CE: 30.0; R=N/A; [M-H]-
MSBNK-ISAS_Dortmund-IA000429
5,6-DIHYDRO-6-HYDROXYMETHYL-3-METHYL-6-NONYL-2H-PY...
1 spectrum
C16H28O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
268.20383
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP005235
5,6-Dihydrothymidine
3 spectra
C10H16N2O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
244.10593
LC-APCI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80448
LC-ESI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80446
LC-ESI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80445
5,6-Dihydrouracil
2 spectra
C4H6N2O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
114.04293
GC-EI-TOF; MS; 2 TMS; BP:73
MSBNK-RIKEN-PR010148
LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M+H]+
MSBNK-RIKEN-PR100394
5,6-Dihydrouracil, 5,6-Dihydro-2,4-dihydroxypyrimi...
1 spectrum
C4H6N2O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
114.10400
LC-ESI-QTOF; MS2
MSBNK-RIKEN_ReSpect-PT109930
5,6-Dihydrouracil, Hydrouracil, 5,6-Dihydro-2,4-di...
2 spectra
C4H6N2O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
114.10400
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS099301
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS099302
5,6-Dihydroxy-3',4'-dimethoxyflavanone
4 spectra
C17H16O6
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
316.09470
LC-ESI-QTOF; MS
MSBNK-BS-BS003535
LC-ESI-QTOF; MS2; CE:10 eV; [M-H]-
MSBNK-BS-BS003533
LC-ESI-QTOF; MS2; CE:20 eV; [M-H]-
MSBNK-BS-BS003534
LC-ESI-QTOF; MS; CE:10 eV; [M-H]-
MSBNK-BS-BS003532
5,6-Dihydroxylutein
1 spectrum
C40H58O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
602.43353
FAB-EBEB; MS2; m/z: 602.43; [M]+*
MSBNK-Kyoto_Univ-CA000073
5,6-Dimethoxynaphtol[2,3-b]furan-4,9-dione
5 spectra
C14H10O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
258.05283
LC-ESI-QTOF; MS2; [M+H]+; CE: 10eV
MSBNK-Fiocruz-FIO00312
LC-ESI-QTOF; MS2; [M+H]+; CE: 20eV
MSBNK-Fiocruz-FIO00313
LC-ESI-QTOF; MS2; [M+H]+; CE: 30eV
MSBNK-Fiocruz-FIO00314
LC-ESI-QTOF; MS2; [M+H]+; CE: 40eV
MSBNK-Fiocruz-FIO00315
LC-ESI-QTOF; MS2; [M+H]+; CE: 50eV
MSBNK-Fiocruz-FIO00316
5,6-Dimethyl-1H-benzotriazol
29 spectra
C8H9N3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
147.07961
LC-ESI-QTOF; MS2; 10 V
MSBNK-BAFG-CSL2311091487
LC-ESI-QTOF; MS2; 10 V
MSBNK-BAFG-CSL2311092030
LC-ESI-QTOF; MS2; 10 V
MSBNK-BAFG-CSL2311094388
LC-ESI-QTOF; MS2; 100 V
MSBNK-BAFG-CSL2311094376
LC-ESI-QTOF; MS2; 110 V
MSBNK-BAFG-CSL2311094385
LC-ESI-QTOF; MS2; 120 V
MSBNK-BAFG-CSL2311094377
LC-ESI-QTOF; MS2; 130 V
MSBNK-BAFG-CSL2311094380
LC-ESI-QTOF; MS2; 140 V
MSBNK-BAFG-CSL2311094384
LC-ESI-QTOF; MS2; 150 V
MSBNK-BAFG-CSL2311094386
LC-ESI-QTOF; MS2; 20 V
MSBNK-BAFG-CSL2311091486
LC-ESI-QTOF; MS2; 20 V
MSBNK-BAFG-CSL2311092029
LC-ESI-QTOF; MS2; 20 V
MSBNK-BAFG-CSL2311094383
LC-ESI-QTOF; MS2; 30 V
MSBNK-BAFG-CSL2311091483
LC-ESI-QTOF; MS2; 30 V
MSBNK-BAFG-CSL2311092027
LC-ESI-QTOF; MS2; 30 V
MSBNK-BAFG-CSL2311094382
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL2311091484
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL2311091488
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL2311092028
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL2311092031
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL2311094375
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL2311094378
LC-ESI-QTOF; MS2; 50 V
MSBNK-BAFG-CSL2311091485
LC-ESI-QTOF; MS2; 50 V
MSBNK-BAFG-CSL2311094387
LC-ESI-QTOF; MS2; 60 V
MSBNK-BAFG-CSL2311091482
LC-ESI-QTOF; MS2; 60 V
MSBNK-BAFG-CSL2311094389
LC-ESI-QTOF; MS2; 70 V
MSBNK-BAFG-CSL2311091481
LC-ESI-QTOF; MS2; 70 V
MSBNK-BAFG-CSL2311094379
LC-ESI-QTOF; MS2; 80 V
MSBNK-BAFG-CSL2311094381
LC-ESI-QTOF; MS2; 90 V
MSBNK-BAFG-CSL2311094390
5,6-dimethyl-1H-benzotriazole
1 spectrum
C8H9N3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
147.07965
LC-ESI-QTOF; MS2; CE: RAMP 16.1-24.2 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU405406
5,6-Dimethylbenzimidazol
5 spectra
C9H10N2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
146.08440
LC-ESI-QQ; MS2; CE:10 V; [M+H]+
MSBNK-Keio_Univ-KO002751
LC-ESI-QQ; MS2; CE:20 V; [M+H]+
MSBNK-Keio_Univ-KO002752
LC-ESI-QQ; MS2; CE:30 V; [M+H]+
MSBNK-Keio_Univ-KO002753
LC-ESI-QQ; MS2; CE:40 V; [M+H]+
MSBNK-Keio_Univ-KO002754
LC-ESI-QQ; MS2; CE:50 V; [M+H]+
MSBNK-Keio_Univ-KO002755
5,6-Dimethylbenzimidazole
4 spectra
C9H10N2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
146.08440
LC-APCI-QFT; MS2; CE: Ramp 20%-70% (nominal); R=30000; [M+H]+
MSBNK-ACES_SU-AS000076
LC-APCI-QFT; MS2; CE: Ramp 20%-70% (nominal); R=30000; [M-H]-
MSBNK-ACES_SU-AS000026
LC-ESI-QFT; MS2; CE: Ramp 20%-70% (nominal); R=30000; [M+H]+
MSBNK-ACES_SU-AS000147
LC-ESI-QFT; MS2; CE: Ramp 20%-70% (nominal); R=30000; [M-H]-
MSBNK-ACES_SU-AS000221
5,6-Dimethylbenzotriazole
13 spectra
C8H9N3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
147.07965
LC-ESI-ITFT; MS2; 80-110; R=7500; [M+H]+
MSBNK-Eawag_Additional_Specs-ETS00120
LC-ESI-QTOF; MS2; CE: 10eV; R=7000; [M+H]+
MSBNK-Antwerp_Univ-AN124902
LC-ESI-QTOF; MS2; CE: 15eV; R=7000; [M+H]+
MSBNK-Antwerp_Univ-AN124903
LC-ESI-QTOF; MS2; CE: 20eV; R=7000; [M+H]+
MSBNK-Antwerp_Univ-AN124904
LC-ESI-QTOF; MS2; CE: 25eV; R=7000; [M+H]+
MSBNK-Antwerp_Univ-AN124905
LC-ESI-QTOF; MS2; CE: 30eV; R=7000; [M+H]+
MSBNK-Antwerp_Univ-AN124906
LC-ESI-QTOF; MS2; CE: 35eV; R=7000; [M+H]+
MSBNK-Antwerp_Univ-AN124907
LC-ESI-QTOF; MS2; CE: 40eV; R=7000; [M+H]+
MSBNK-Antwerp_Univ-AN124908
LC-ESI-QTOF; MS2; CE: 45eV; R=7000; [M+H]+
MSBNK-Antwerp_Univ-AN124909
LC-ESI-QTOF; MS2; CE: 50eV; R=7000; [M+H]+
MSBNK-Antwerp_Univ-AN124910
LC-ESI-QTOF; MS2; CE: 55eV; R=7000; [M+H]+
MSBNK-Antwerp_Univ-AN124911
LC-ESI-QTOF; MS2; CE: 5eV; R=7000; [M+H]+
MSBNK-Antwerp_Univ-AN124901
LC-ESI-QTOF; MS2; CE: 60eV; R=7000; [M+H]+
MSBNK-Antwerp_Univ-AN124912
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