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(3R,3.alpha.)-1-(1S,2S)-[[1-(Hydroxy)methyl)cyclohex-4-en-2-yl]methyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
SpectraBase Compound ID Ij5Vf2fVDwo
InChI InChI=1S/C19H24N2O/c22-12-14-6-2-1-5-13(14)11-18-19-16(9-10-20-18)15-7-3-4-8-17(15)21-19/h1-4,7-8,13-14,18,20-22H,5-6,9-12H2/t13-,14+,18-/m0/s1
InChIKey CTDQTCXEGDYAPH-IYOUNJFTSA-N
Mol Weight 296.41 g/mol
Molecular Formula C19H24N2O
Exact Mass 296.188863 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4LLBoWAmQeL
Name (3R,3.alpha.)-1-(1S,2S)-[[1-(Hydroxy)methyl)cyclohex-4-en-2-yl]methyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
Alternate Name(s) [(1S,6S)-6-[[(1S)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl]methyl]-1-cyclohex-3-enyl]methanol [(1S,6S)-6-[[(1S)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl]methyl]cyclohex-3-en-1-yl]methanol
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Formula C19H24N2O
InChI InChI=1S/C19H24N2O/c22-12-14-6-2-1-5-13(14)11-18-19-16(9-10-20-18)15-7-3-4-8-17(15)21-19/h1-4,7-8,13-14,18,20-22H,5-6,9-12H2/t13-,14+,18-/m0/s1
InChIKey CTDQTCXEGDYAPH-IYOUNJFTSA-N
Molecular Weight 296.414 g/mol
SMILES [nH]1c2ccccc2c2c1[C@](C[C@]1([C@@](CO)(CC=CC1)[H])[H])(NCC2)[H]
SPLASH splash10-00di-0920000000-98410efe290fc159cc86
Source of Spectrum J-60-2510-12
Wiley ID 1299524