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23,294 molecules found

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• (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; MS; [M+H]+
  • Ajmaline; LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
  • Ajmaline; LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
  • Ajmaline; LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
  • Ajmaline; LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [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: 20; 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]+

• (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; MS2; Frag=135.0V CID@5.0; [M+H]+
  • Lauberine; LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
  • Lauberine; LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
  • Lauberine; LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
  • Lauberine; LC-ESI-QQQ; MS; [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; 30 V
  • Estrone sulfate; LC-ESI-QTOF; MS2; 80 V
  • Estrone sulfate; LC-ESI-QTOF; MS2; 40 V
  • Estrone-3-sulfate; LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-
  • Estrone sulfate; LC-ESI-QTOF; MS2; 50 V
  • Estrone sulfate; LC-ESI-QTOF; MS2; 40 V
  • Estrone sulfate; LC-ESI-QTOF; MS2; 10 V
  • Estrone sulfate; LC-ESI-QTOF; MS2; 110 V
  • Estrone sulfate; LC-ESI-QTOF; MS2; 150 V
  • Estrone sulfate; LC-ESI-QTOF; MS2; 60 V
  • Estrone sulfate; LC-ESI-QTOF; MS2; 130 V
  • Estrone sulfate; LC-ESI-QTOF; MS2; 70 V
  • Estrone sulfate; LC-ESI-QTOF; MS2; 20 V
  • Estrone sulfate; LC-ESI-QTOF; MS2; 90 V
  • Estrone sulfate; LC-ESI-QTOF; MS2; 140 V
  • Estrone sulfate; LC-ESI-QTOF; MS2; 100 V
  • Estrone sulfate; LC-ESI-QTOF; MS2; 120 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]+
  • Huperzine A; LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
  • Huperzine A; LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
  • HuperzineA; LC-ESI-QTOF; MS; POSITIVE
  • Huperzine A; LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
  • HuperzineA; LC-APCI-QTOF; MS; POSITIVE

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

• (13S,17S)-17-hydroxy-13-methyl-2,6,7,8,14,15,16,17-octahydro-1H-cyclopenta[a]... Molecule

  InChIKey	MEHHPFQKXOUFFV-FOIPXRHGSA-N
  Molecular Formula	C18H22O2

  

  
  

  Related Dataset(s)

  • Trenbolone; LC-ESI-ITFT; MS2; CE: 50%; R=15000; [M+H]+
  • Trenbolone; LC-ESI-ITFT; MS2; CE: 60%; R=15000; [M+H]+
  • Trenbolone; LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M+H]+
  • Trenbolone; LC-ESI-ITFT; MS2; CE: 40%; R=15000; [M+H]+
  • Trenbolone; LC-ESI-QTOF; MS2; CE: 50 eV; R=35000; [M+H]+
  • Trenbolone; LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M+H]+
  • Trenbolone; LC-ESI-QTOF; MS2; CE: 40 eV; R=35000; [M+H]+
  • Trenbolone; LC-ESI-QTOF; MS2; CE: Ramp 20.6-30.8 eV; R=35000; [M+H]+
  • Trenbolone; LC-ESI-ITFT; MS2; CE: 80%; R=15000; [M+H]+
  • Trenbolone; LC-ESI-ITFT; MS2; CE: 70%; R=15000; [M+H]+
  • Trenbolone; LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M+H]+
  • Trenbolone; LC-ESI-ITFT; MS2; CE: 90%; R=15000; [M+H]+

• (13aR)-2,3,9,10-tetramethoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoq... Molecule

  InChIKey	AEQDJSLRWYMAQI-QGZVFWFLSA-N
  Molecular Formula	C21H25NO4

  

  
  

  Related Dataset(s)

  • Tetrahydropalmatin; LC-ESI-ITFT; MS2; CE: 75%; R=15000; [M+H]+
  • Tetrahydropalmatin; LC-ESI-ITFT; MS2; CE: 70%; R=15000; [M+H]+
  • Tetrahydropalmatin; LC-ESI-ITFT; MS2; CE: 30%; R=15000; [M+H]+
  • Tetrahydropalmatin; LC-ESI-ITFT; MS2; CE: 80%; R=15000; [M+H]+
  • Tetrahydropalmatin; LC-ESI-ITFT; MS2; CE: 25%; R=15000; [M+H]+
  • Tetrahydropalmatine; LC-ESI-QQQ; MS; [M+H]+
  • Tetrahydropalmatin; LC-ESI-ITFT; MS2; CE: 90%; R=15000; [M+H]+
  • Tetrahydropalmatin; LC-ESI-ITFT; MS2; CE: 65%; R=15000; [M+H]+
  • Tetrahydropalmatin; LC-ESI-ITFT; MS2; CE: 50%; R=15000; [M+H]+
  • Tetrahydropalmatin; LC-ESI-ITFT; MS2; CE: 20%; R=15000; [M+H]+
  • Tetrahydropalmatin; LC-ESI-ITFT; MS2; CE: 60%; R=15000; [M+H]+
  • Tetrahydropalmatin; LC-ESI-ITFT; MS2; CE: 45%; R=15000; [M+H]+
  • Tetrahydropalmatin; LC-ESI-ITFT; MS2; CE: 105%; R=15000; [M+H]+
  • Tetrahydropalmatin; LC-ESI-ITFT; MS2; CE: 55%; R=15000; [M+H]+
  • Tetrahydropalmatin; LC-ESI-ITFT; MS2; CE: 40%; R=15000; [M+H]+
  • Tetrahydropalmatin; LC-ESI-ITFT; MS2; CE: 35%; R=15000; [M+H]+
  • Tetrahydropalmatin; LC-ESI-ITFT; MS2; CE: 15%; R=15000; [M+H]+
  • Tetrahydropalmatin; LC-ESI-ITFT; MS2; CE: 100%; R=15000; [M+H]+
  • Tetrahydropalmatin; LC-ESI-ITFT; MS2; CE: 85%; R=15000; [M+H]+
  • Tetrahydropalmatin; LC-ESI-ITFT; MS2; CE: 10%; R=15000; [M+H]+
  • Tetrahydropalmatin; LC-ESI-ITFT; MS2; CE: 95%; R=15000; [M+H]+

• (13aS)-12-bromo-3,9-dihexoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoq... Molecule

  InChIKey	PVXJKZIZVPZHDE-VWLOTQADSA-N

  

  
  

  Related Dataset(s)

  • Hexyl hexyl[2]
  • Hexyl hexyl[3]
  • Hexyl hexyl[1]

• (13aS)-12-bromo-3,9-dipropoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]iso... Molecule

  InChIKey	YRIGEEYYMGNBLH-IBGZPJMESA-N

  

  
  

  Related Dataset(s)

  • Propyl Propyl final dried data.topspin[3]
  • Propyl Propyl final dried data.topspin[1]
  • Propyl Propyl final dried data.topspin[4]
  • Propyl Propyl final dried data.topspin[2]

• (13aS)-12-bromo-3-hexoxy-9-pentoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-... Molecule

  InChIKey	SMQYAHMIUKDWPQ-DEOSSOPVSA-N

  

  
  

  Related Dataset(s)

  • hexyl pentyl[2]
  • hexyl pentyl[3]

• (13aS)-12-bromo-3-hexoxy-9-propoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-... Molecule

  InChIKey	VOWZUTQGRBJLDH-QFIPXVFZSA-N

  

  
  

  Related Dataset(s)

  • Hexyl Propyl[1]
  • Hexyl Propyl[2]

• (13aS)-12-bromo-9-(2-ethoxyethoxy)-3-hexoxy-6,8,13,13a-tetrahydro-5H-isoquino... Molecule

  InChIKey	LHHCQDFZJQYUSF-QHCPKHFHSA-N

  

  
  

  Related Dataset(s)

  • Hexyl Ethoxy ethyl[2]
  • Hexyl Ethoxy ethyl[3]
  • Hexyl Ethoxy ethyl[1]

• (13aS)-12-bromo-9-(2-ethoxyethoxy)-3-propoxy-6,8,13,13a-tetrahydro-5H-isoquin... Molecule

  InChIKey	RMKVCRINIVDQQR-FQEVSTJZSA-N

  

  
  

  Related Dataset(s)

  • Propyl Ethoxy Ethyl final Data.topspin[1]
  • Propyl Ethoxy Ethyl final Data.topspin[2]

• (13aS)-12-bromo-9-butoxy-3-hexoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b... Molecule

  InChIKey	SJWXAQHBAPRXPD-QHCPKHFHSA-N

  

  
  

  Related Dataset(s)

  • Hexyl Butyl Final[2]
  • Hexyl Butyl Final[1]

• (13aS)-12-bromo-9-butoxy-3-propoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-... Molecule

  InChIKey	ANDDNJUYPNMKJQ-FQEVSTJZSA-N

  

  
  

  Related Dataset(s)

  • Propyl butyl[1]
  • Propyl butyl[2]

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