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25,361 molecules found

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• (11-ethyl-3,8-dihydroxy-4,6,16-trimethoxy-11-azahexacyclo[7.7.2.12,5.01,10.03... Molecule

  InChIKey	VSUODASNSRJNCP-UHFFFAOYSA-N
  Molecular Formula	C30H42N2O7

  

  
  

  Related Dataset(s)

  • Puberanidine; LC-ESI-QTOF; MS2

• (11-ethyl-8,9-dihydroxy-4,6,16,18-tetramethoxy-11-azahexacyclo[7.7.2.12,5.01,... Molecule

  InChIKey	XLTANAWLDBYGFU-UHFFFAOYSA-N
  Molecular Formula	C37H50N2O10

  

  
  

  Related Dataset(s)

  • Methyllycaconitine; LC-ESI-QTOF; MS2; CE 10 ev; [M+H]+
  • Methyllycaconitine; LC-APCI-QTOF; MS; NEGATIVE
  • Methyllycaconitine; LC-ESI-QTOF; MS2; CE 20 ev; [M+H]+
  • Methyllycaconitine; LC-APCI-QTOF; MS; POSITIVE
  • Methyllycaconitine; LC-ESI-QTOF; MS; POSITIVE
  • Methyllycaconitine; LC-ESI-QTOF; MS2; CE 40 ev; [M+H]+
  • Methyllycaconitine; LC-ESI-QTOF; MS; NEGATIVE

• (11-ethyl-8,9-dihydroxy-4,6,16,18-tetramethoxy-11-azahexacyclo[7.7.2.12,5.01,... Molecule

  InChIKey	NNDHDYDFEDRMGH-UHFFFAOYSA-N
  Molecular Formula	C32H46N2O8

  

  
  

  Related Dataset(s)

  • Anthranoyllycoctonine; LC-ESI-QTOF; MS2

• (11R,15R,17R)-4-hydroxy-17-methyl-12,16-dioxatetracyclo[8.7.0.03,8.011,15]hep... Molecule

  InChIKey	XUWPJKDMEZSVTP-LTYMHZPRSA-N
  Molecular Formula	C16H12O6

  

  
  

  Related Dataset(s)

  • KALAMYCIN; FD-B; MS

• (11S,12E)-12-ethylidene-8,14-diazapentacyclo[9.5.2.01,9.02,7.014,17]octadeca-... Molecule

  InChIKey	VFUITWPFKLGEQA-IJEMKVKBSA-N
  Molecular Formula	C19H20N2O

  

  
  

  Related Dataset(s)

  • Nor-C-fluorocurarine; LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
  • Nor-C-fluorocurarine; LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
  • Nor-C-fluorocurarine; LC-ESI-QQQ; MS; [M+H]+
  • Nor-C-fluorocurarine; LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
  • Nor-C-fluorocurarine; LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+

• (11S,12E,17S)-12-ethylidene-6-hydroxy-8,14-diazapentacyclo[9.5.2.01,9.02,7.01... Molecule

  InChIKey	JDOFCMASVRMYJU-PCKYSSEZSA-N
  Molecular Formula	C19H20N2O2

  

  
  

  Related Dataset(s)

  • Vincanidine; LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
  • Vincanidine; LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
  • Vincanidine; LC-ESI-QQQ; MS; [M+H]+
  • Vincanidine; LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
  • Vincanidine; LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+

• (11Z,14Z)-icosa-11,14-dienoic acid Molecule

  InChIKey	XSXIVVZCUAHUJO-HZJYTTRNSA-N
  Molecular Formula	C20H36O2

  

  
  

  Related Dataset(s)

  • Dihomolinoleic acid (20:2(n-6)); LC-ESI-IT; MS2; m/z: 307.3; [M-H]-

• (11Z,14Z,17Z)-icosa-11,14,17-trienoic acid Molecule

  InChIKey	AHANXAKGNAKFSK-PDBXOOCHSA-N
  Molecular Formula	C20H34O2

  

  
  

  Related Dataset(s)

  • Dihomo-alpha-linolenic acid (20:3(n-3)); LC-ESI-IT; MS2; m/z: 305.4; [M-H]-

• (12E,23E)-1,8-diazoniahexacyclo[23.2.2.23,6.28,11.114,18.022,30]tetratriacont... Molecule

  InChIKey	ZJSPYAOOLGYBTI-VCHVFRDLSA-L
  Molecular Formula	C32H26Cl2N2

  

  
  

  Related Dataset(s)

  • infrared absorption spectroscopy (IR)
  • 13C nuclear magnetic resonance spectroscopy (13C NMR)
  • mass spectrometry (MS)
  • 1H nuclear magnetic resonance spectroscopy (1H NMR)

• (12R)-11-methyl-3,5-dioxa-11-azapentacyclo[10.7.1.02,6.08,20.014,19]icosa-1(2... Molecule

  InChIKey	JCTYWRARKVGOBK-CQSZACIVSA-N
  Molecular Formula	C18H17NO2

  

  
  

  Related Dataset(s)

  • Roemerine; LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
  • Roemerine; LC-ESI-QQQ; MS; [M+H]+
  • Roemerine; LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
  • Roemerine; LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
  • Roemerine; LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+

• (12R)-30-ethyl-33-[(E,1R,2R)-1-hydroxy-2-methylhex-4-enyl]-1,4,7,10,12,15,19,... Molecule

  InChIKey	PMATZTZNYRCHOR-NFOUMSERSA-N
  Molecular Formula	C62H111N11O12

  

  
  

  Related Dataset(s)

  • Cyclosporin A; LC-ESI-QQQ; MS; [M+H]+

• (12R,14R,16S,18S)-13-ethyl-8-methyl-8,15-diazahexacyclo[14.2.1.01,9.02,7.010,... Molecule

  InChIKey	CJDRUOGAGYHKKD-PSOGFBMNSA-N
  Molecular Formula	C20H26N2O2

  

  
  

  Related Dataset(s)

  • Ajmaline; LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
  • Ajmaline; LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
  • Ajmaline; LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
  • Ajmaline; LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
  • Ajmaline; LC-ESI-QQQ; MS; [M+H]+

• (12S)-18,19-dimethoxy-13-methyl-5,7-dioxa-13-azapentacyclo[10.7.1.02,10.04,8.... Molecule

  InChIKey	WSVWKHTVFGTTKJ-AWEZNQCLSA-N
  Molecular Formula	C20H21NO4

  

  
  

  Related Dataset(s)

  • Nantenine; LC-ESI-QTOF; MS2
  • Nantenine; LC-ESI-QTOF; MS2
  • Nantenine; LC-ESI-QTOF; MS2
  • Nantenine; LC-ESI-QTOF; MS2
  • Nantenine; LC-ESI-QTOF; MS2
  • Nantenine; LC-ESI-QTOF; MS2
  • Nantenine; LC-ESI-QTOF; MS2

• (12S)-6,15-dihydroxy-8,12,13,13-tetramethyl-4,11-dioxatetracyclo[7.6.1.05,16.... Molecule

  InChIKey	MYDJDVOVZVSVIE-ZETCQYMHSA-N
  Molecular Formula	C18H16O6

  

  
  

  Related Dataset(s)

  • Scleroderolide; LC-ESI-ITFT; MS2; CE: 10; R=17500; [M+H]+
  • Scleroderolide; LC-ESI-ITFT; MS2; CE: 55; R=17500; [M+H]+
  • Scleroderolide; LC-ESI-ITFT; MS2; CE: 40; R=17500; [M+H]+
  • Scleroderolide; LC-ESI-ITFT; MS2; CE: 30; R=17500; [M+H]+
  • Scleroderolide; LC-ESI-ITFT; MS2; CE: 20; R=17500; [M+H]+

• (12S,13S,16Z,17S)-3,4,6-trimethoxy-16-(2-methoxyethylidene)-10-oxa-8,14-diaza... Molecule

  InChIKey	RIMDDIPKIZTBHU-KPDHXFAYSA-N
  Molecular Formula	C23H28N2O5

  

  
  

  Related Dataset(s)

  • Gardneramine; LC-ESI-QTOF; MS2
  • Gardneramine; LC-ESI-QTOF; MS2
  • Gardneramine; LC-ESI-QTOF; MS2
  • Gardneramine; LC-ESI-QTOF; MS2
  • Gardneramine; LC-ESI-QTOF; MS2
  • Gardneramine; LC-ESI-QTOF; MS2
  • Gardneramine; LC-ESI-QTOF; MS2
  • Gardneramine; LC-ESI-QTOF; MS2
  • Gardneramine; LC-ESI-QTOF; MS2
  • Gardneramine; LC-ESI-QTOF; MS2
  • Gardneramine; LC-ESI-QTOF; MS2
  • Gardneramine; LC-ESI-QTOF; MS2

• (12S,25R)-5,20,31-trimethoxy-11,26-dimethyl-2,18-dioxa-11,26-diazaheptacyclo[... Molecule

  InChIKey	CASHVZNATRNXDE-IHLOFXLRSA-N
  Molecular Formula	C37H40N2O6

  

  
  

  Related Dataset(s)

  • Lauberine; LC-ESI-QQQ; MS; [M+H]+
  • Lauberine; LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
  • Lauberine; LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
  • Lauberine; LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
  • Lauberine; LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+

• (13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-... Molecule

  InChIKey	JKKFKPJIXZFSSB-UHFFFAOYSA-N
  Molecular Formula	C18H22O5S

  

  
  

  Related Dataset(s)

  • Estrone sulfate; LC-ESI-QTOF; MS2; 100 V
  • Estrone sulfate; LC-ESI-QTOF; MS2; 140 V
  • Estrone sulfate; LC-ESI-QTOF; MS2; 50 V
  • Estrone sulfate; LC-ESI-QTOF; MS2; 70 V
  • Estrone sulfate; LC-ESI-QTOF; MS2; 130 V
  • Estrone sulfate; LC-ESI-QTOF; MS2; 80 V
  • Estrone-3-sulfate; LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-
  • Estrone sulfate; LC-ESI-QTOF; MS2; 30 V
  • Estrone sulfate; LC-ESI-QTOF; MS2; 20 V
  • Estrone sulfate; LC-ESI-QTOF; MS2; 40 V
  • Estrone sulfate; LC-ESI-QTOF; MS2; 10 V
  • Estrone sulfate; LC-ESI-QTOF; MS2; 150 V
  • Estrone sulfate; LC-ESI-QTOF; MS2; 40 V
  • Estrone sulfate; LC-ESI-QTOF; MS2; 60 V
  • Estrone sulfate; LC-ESI-QTOF; MS2; 90 V
  • Estrone sulfate; LC-ESI-QTOF; MS2; 120 V
  • Estrone sulfate; LC-ESI-QTOF; MS2; 110 V

• (13E)-1-amino-13-ethylidene-11-methyl-6-azatricyclo[7.3.1.02,7]trideca-2(7),3... Molecule

  InChIKey	ZRJBHWIHUMBLCN-QDEBKDIKSA-N
  Molecular Formula	C15H18N2O

  

  
  

  Related Dataset(s)

  • Huperzine A; LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
  • HuperzineA; LC-APCI-QTOF; MS; POSITIVE
  • Huperzine A; LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
  • HuperzineA; LC-ESI-QTOF; MS; POSITIVE
  • Huperzine A; LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
  • Huperzine A; LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+

• (13R,21R,24S)-6-amino-3,24,28-trihydroxy-21-methoxy-7-methyl-14,16,19-trioxa-... Molecule

  InChIKey	PUQUSQASXBNKCW-BFHYXJOUSA-N
  Molecular Formula	C27H24N2O9

  

  
  

  Related Dataset(s)

  • KANCHANOMYCIN; FD-B; MS

• (13S,13aR)-2,3,9,10-tetramethoxy-13-methyl-6,8,13,13a-tetrahydro-5H-isoquinol... Molecule

  InChIKey	VRSRXLJTYQVOHC-YEJXKQKISA-N
  Molecular Formula	C22H27NO4

  

  
  

  Related Dataset(s)

  • (+)-Corydaline; LC-ESI-QTOF; MS2
  • (+)-Corydaline; LC-ESI-QTOF; MS2
  • (+)-Corydaline; LC-ESI-QTOF; MS2
  • (+)-Corydaline; LC-ESI-QTOF; MS2
  • (+)-Corydaline; LC-ESI-QTOF; MS2
  • (+)-Corydaline; LC-ESI-QTOF; MS2
  • (+)-Corydaline; LC-ESI-QTOF; MS2
  • (+)-Corydaline; LC-ESI-QTOF; MS2
  • (+)-Corydaline; LC-ESI-QTOF; MS2
  • Corydaline; LC-ESI-ITTOF; MS; [M+H]+
  • (+)-Corydaline; LC-ESI-QTOF; MS2
  • (+)-Corydaline; LC-ESI-QTOF; MS2
  • (+)-Corydaline; LC-ESI-QTOF; MS2

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