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Name
Formula / Structure
ExactMass
ID
6-Propyl-2-thiouracil
6 spectra
C7H10N2OS
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
170.05141
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
MSBNK-LCSB-LU032451
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
MSBNK-LCSB-LU032452
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
MSBNK-LCSB-LU032453
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
MSBNK-LCSB-LU032454
LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
MSBNK-LCSB-LU032455
LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
MSBNK-LCSB-LU032456
6-Quinolinol
1 spectrum
C9H7NO
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
145.05280
LC-ESI-QFT; MS2; CE: 61.67%; R=35000; [M+H]+
MSBNK-UFZ-UA006901
6-QUINOLYLMETHYL 2-METHYLBENZOATE
1 spectrum
C18H15NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
277.11029
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP011466
6-SEC-BUTYL QUINOLINE
1 spectrum
C13H15N
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
185.12045
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP005808
6-TERT-BUTYLMERCAPTO-2-PICOLINE
1 spectrum
C10H15NS
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
181.09251
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP003012
6-TETRADECYLSALICYLIC ACID
1 spectrum
C21H34O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
334.25079
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP008038
6-Thioguanine
18 spectra
C5H5N5S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
167.02660
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
MSBNK-LCSB-LU064001
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
MSBNK-LCSB-LU064051
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
MSBNK-LCSB-LU064002
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
MSBNK-LCSB-LU064052
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
MSBNK-LCSB-LU064003
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
MSBNK-LCSB-LU064053
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
MSBNK-LCSB-LU064004
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
MSBNK-LCSB-LU064054
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
MSBNK-LCSB-LU064005
LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
MSBNK-LCSB-LU064055
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
MSBNK-LCSB-LU064006
LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
MSBNK-LCSB-LU064056
LC-ESI-QTOF; MS2; 10 V
MSBNK-BAFG-CSL2311093570
LC-ESI-QTOF; MS2; 20 V
MSBNK-BAFG-CSL2311093567
LC-ESI-QTOF; MS2; 30 V
MSBNK-BAFG-CSL2311093568
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL2311093569
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL2311093571
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL2311108240
6-Thioxanthine
5 spectra
C5H4N4OS
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
168.01060
LC-ESI-QTOF; MS2; 10 V
MSBNK-BAFG-CSL2311109531
LC-ESI-QTOF; MS2; 20 V
MSBNK-BAFG-CSL2311109530
LC-ESI-QTOF; MS2; 30 V
MSBNK-BAFG-CSL2311109532
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL2311109529
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL2311109533
6-TRIMETHYLSILYL-5-VINYLCYCLOHEXAN-2-ONE
1 spectrum
C11H22OSi
198.14400
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP012108
6-TRIMETHYLSILYLMETHYL-2,3,3A,4,7,7A-HEXAHYDROINDE...
1 spectrum
C13H22OSi
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
222.14400
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP002485
6-TRIMETHYLSILYLMETHYL-3,4,4A,5,8,8A-HEXAHYDRO-1(2...
1 spectrum
C14H24OSi
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
236.15964
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP004727
6-UNDECANONE
2 spectra
C11H22O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
170.16707
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP007050
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP008910
62FTA
13 spectra
C8H3F13O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
377.99255
LC-ESI-QQ; MS
MSBNK-PFOS_research_group-FFF00393
LC-ESI-QQ; MS2; CE10; [M-H-CO2-2HF]-
MSBNK-PFOS_research_group-FFF00400
LC-ESI-QQ; MS2; CE10; [M-H]-
MSBNK-PFOS_research_group-FFF00394
LC-ESI-QQ; MS2; CE20; [M-H-CO2-2HF]-
MSBNK-PFOS_research_group-FFF00401
LC-ESI-QQ; MS2; CE20; [M-H]-
MSBNK-PFOS_research_group-FFF00395
LC-ESI-QQ; MS2; CE30; [M-H-CO2-2HF]-
MSBNK-PFOS_research_group-FFF00402
LC-ESI-QQ; MS2; CE30; [M-H]-
MSBNK-PFOS_research_group-FFF00396
LC-ESI-QQ; MS2; CE40; [M-H-CO2-2HF]-
MSBNK-PFOS_research_group-FFF00403
LC-ESI-QQ; MS2; CE40; [M-H]-
MSBNK-PFOS_research_group-FFF00397
LC-ESI-QQ; MS2; CE50; [M-H-CO2-2HF]-
MSBNK-PFOS_research_group-FFF00404
LC-ESI-QQ; MS2; CE50; [M-H]-
MSBNK-PFOS_research_group-FFF00398
LC-ESI-QQ; MS2; CE60; [M-H-CO2-2HF]-
MSBNK-PFOS_research_group-FFF00405
LC-ESI-QQ; MS2; CE60; [M-H]-
MSBNK-PFOS_research_group-FFF00399
6:2 fluorotelomer sulfonic acid
4 spectra
C8H5F13O3S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
427.97519
LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M-H]-
MSBNK-Athens_Univ-AU230457
LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M-H]-
MSBNK-Athens_Univ-AU230458
LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M-H]-
MSBNK-Athens_Univ-AU230459
LC-ESI-QTOF; MS2; CE: 40 eV; R=35000; [M-H]-
MSBNK-Athens_Univ-AU230460
6:2 Fluorotelomer sulfonic acid
1 spectrum
C8H5F13O3S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
427.97519
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-
MSBNK-CASMI_2016-SM883655
6:2 fluorotelomer unsaturated carboxylic acid
13 spectra
C8H2F12O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
357.98630
LC-ESI-ITFT; MS2; CE: 15%; R=15000; [M-H]-
MSBNK-Eawag-EA273258
LC-ESI-ITFT; MS2; CE: 15%; R=7500; [M-H]-
MSBNK-Eawag-EA273252
LC-ESI-ITFT; MS2; CE: 30%; R=15000; [M-H]-
MSBNK-Eawag-EA273259
LC-ESI-ITFT; MS2; CE: 30%; R=7500; [M-H]-
MSBNK-Eawag-EA273253
LC-ESI-ITFT; MS2; CE: 35%; R=7500; [M-H]-
MSBNK-Eawag-EA273251
LC-ESI-ITFT; MS2; CE: 45%; R=15000; [M-H]-
MSBNK-Eawag-EA273260
LC-ESI-ITFT; MS2; CE: 45%; R=7500; [M-H]-
MSBNK-Eawag-EA273254
LC-ESI-ITFT; MS2; CE: 60%; R=15000; [M-H]-
MSBNK-Eawag-EA273261
LC-ESI-ITFT; MS2; CE: 60%; R=7500; [M-H]-
MSBNK-Eawag-EA273255
LC-ESI-ITFT; MS2; CE: 75%; R=15000; [M-H]-
MSBNK-Eawag-EA273262
LC-ESI-ITFT; MS2; CE: 75%; R=7500; [M-H]-
MSBNK-Eawag-EA273256
LC-ESI-ITFT; MS2; CE: 90%; R=15000; [M-H]-
MSBNK-Eawag-EA273263
LC-ESI-ITFT; MS2; CE: 90%; R=7500; [M-H]-
MSBNK-Eawag-EA273257
6:3+6O fatty acyl hexoside
1 spectrum
C12H18O12
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
354.26401
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR309336
6`-Hydroxymethyl Simvastatin
16 spectra
C25H38O6
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
434.26682
LC-ESI-QTOF; MS2; 10 V
MSBNK-BAFG-CSL23111010051
LC-ESI-QTOF; MS2; 100 V
MSBNK-BAFG-CSL23111010050
LC-ESI-QTOF; MS2; 110 V
MSBNK-BAFG-CSL23111010058
LC-ESI-QTOF; MS2; 120 V
MSBNK-BAFG-CSL23111010048
LC-ESI-QTOF; MS2; 130 V
MSBNK-BAFG-CSL23111010055
LC-ESI-QTOF; MS2; 140 V
MSBNK-BAFG-CSL23111010060
LC-ESI-QTOF; MS2; 150 V
MSBNK-BAFG-CSL23111010052
LC-ESI-QTOF; MS2; 20 V
MSBNK-BAFG-CSL23111010047
LC-ESI-QTOF; MS2; 30 V
MSBNK-BAFG-CSL23111010045
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111010046
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111010056
LC-ESI-QTOF; MS2; 50 V
MSBNK-BAFG-CSL23111010053
LC-ESI-QTOF; MS2; 60 V
MSBNK-BAFG-CSL23111010057
LC-ESI-QTOF; MS2; 70 V
MSBNK-BAFG-CSL23111010059
LC-ESI-QTOF; MS2; 80 V
MSBNK-BAFG-CSL23111010054
LC-ESI-QTOF; MS2; 90 V
MSBNK-BAFG-CSL23111010049
6a,12a-Didehydroamorphigenin
8 spectra
C23H20O7
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
408.12091
LC-APCI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80518
LC-APCI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80517
LC-ESI-QTOF; MS2; CE 10 ev; [M+H]+
MSBNK-Washington_State_Univ-BML00166
LC-ESI-QTOF; MS2; CE 10 ev; [M-H]-
MSBNK-Washington_State_Univ-BML00207
LC-ESI-QTOF; MS2; CE 20 ev; [M+H]+
MSBNK-Washington_State_Univ-BML00180
LC-ESI-QTOF; MS2; CE 20 ev; [M-H]-
MSBNK-Washington_State_Univ-BML00220
LC-ESI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80516
LC-ESI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80515
6a-Hydroxy-5a-cholan-24-oic acid
3 spectra
C24H40O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
376.29776
LC-ESI-TOF; MS; NEGATIVE; In source decay -120 V
MSBNK-Nihon_Univ-NU000564
LC-ESI-TOF; MS; NEGATIVE; In source decay -60 V
MSBNK-Nihon_Univ-NU000562
LC-ESI-TOF; MS; NEGATIVE; In source decay -90 V
MSBNK-Nihon_Univ-NU000563
6a-Hydroxy-5b-cholan-24-oic acid
2 spectra
C24H40O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
376.29776
LC-ESI-TOF; MS; Negative; Orifice voltage -30 V
MSBNK-Nihon_Univ-NU000451
LC-ESI-TOF; MS; Negative; Orifice voltage -50 V
MSBNK-Nihon_Univ-NU000452
6a_Methylprednisolone
11 spectra
C22H30O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
374.20932
LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU281001
LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU281002
LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU281003
LC-ESI-QTOF; MS2; CE: 40 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU281004
LC-ESI-QTOF; MS2; CE: 50 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU281005
LC-ESI-QTOF; MS2; CE: Ramp 23.1-34.7 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU281006
LC-ESI-QTOF; MS2; CE:10 eV; [M+H]+
MSBNK-Univ_Connecticut-CO000006
LC-ESI-QTOF; MS2; CE:20 eV; [M+H]+
MSBNK-Univ_Connecticut-CO000007
LC-ESI-QTOF; MS2; CE:30 eV; [M+H]+
MSBNK-Univ_Connecticut-CO000008
LC-ESI-QTOF; MS2; CE:40 eV; [M+H]+
MSBNK-Univ_Connecticut-CO000009
LC-ESI-QTOF; MS2; CE:50 eV; [M+H]+
MSBNK-Univ_Connecticut-CO000010
6alpha Methylprednisolone
3 spectra
C22H30O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
374.20932
LC-ESI-ITFT; MS2; CE: 10%; R=15000; [M+H]+
MSBNK-UFZ-WANA222601AD6CPH
LC-ESI-ITFT; MS2; CE: 20%; R=15000; [M+H]+
MSBNK-UFZ-WANA222603B085PH
LC-ESI-ITFT; MS2; CE: 30%; R=15000; [M+H]+
MSBNK-UFZ-WANA222605070APH
6alpha-Hydroxy-5alpha-cholan-24-oic acid Methyl es...
1 spectrum
C25H42O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
390.31339
EI-B; MS
MSBNK-Nihon_Univ-NU000058
6alpha-Methylprednisolone
16 spectra
C22H30O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
374.20929
LC-ESI-QTOF; MS2; 10 V
MSBNK-BAFG-CSL2311095288
LC-ESI-QTOF; MS2; 100 V
MSBNK-BAFG-CSL2311095289
LC-ESI-QTOF; MS2; 110 V
MSBNK-BAFG-CSL2311095283
LC-ESI-QTOF; MS2; 120 V
MSBNK-BAFG-CSL2311095277
LC-ESI-QTOF; MS2; 130 V
MSBNK-BAFG-CSL2311095280
LC-ESI-QTOF; MS2; 140 V
MSBNK-BAFG-CSL2311095287
LC-ESI-QTOF; MS2; 150 V
MSBNK-BAFG-CSL2311095285
LC-ESI-QTOF; MS2; 20 V
MSBNK-BAFG-CSL2311095274
LC-ESI-QTOF; MS2; 30 V
MSBNK-BAFG-CSL2311095279
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL2311095275
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL2311095276
LC-ESI-QTOF; MS2; 50 V
MSBNK-BAFG-CSL2311095282
LC-ESI-QTOF; MS2; 60 V
MSBNK-BAFG-CSL2311095284
LC-ESI-QTOF; MS2; 70 V
MSBNK-BAFG-CSL2311095286
LC-ESI-QTOF; MS2; 80 V
MSBNK-BAFG-CSL2311095278
LC-ESI-QTOF; MS2; 90 V
MSBNK-BAFG-CSL2311095281
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