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(1S,3S)-2-Benzyl-3-cyanomethyl-1-(2-hydroxyethyl)-2,3,4,9-tetrahydro-9-methyl-1H-pyrido[3,4-b]indole
SpectraBase Compound ID 7xn61FZPYVV
InChI InChI=1S/C23H25N3O/c1-25-21-10-6-5-9-19(21)20-15-18(11-13-24)26(22(12-14-27)23(20)25)16-17-7-3-2-4-8-17/h2-10,18,22,27H,11-12,14-16H2,1H3/t18-,22+/m1/s1
InChIKey DIIZPTUFRBEZDI-GCJKJVERSA-N
Mol Weight 359.47 g/mol
Molecular Formula C23H25N3O
Exact Mass 359.199762 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8AybUkKYuZd
Name (1S,3S)-2-Benzyl-3-cyanomethyl-1-(2-hydroxyethyl)-2,3,4,9-tetrahydro-9-methyl-1H-pyrido[3,4-b]indole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H25N3O
InChI InChI=1S/C23H25N3O/c1-25-21-10-6-5-9-19(21)20-15-18(11-13-24)26(22(12-14-27)23(20)25)16-17-7-3-2-4-8-17/h2-10,18,22,27H,11-12,14-16H2,1H3/t18-,22+/m1/s1
InChIKey DIIZPTUFRBEZDI-GCJKJVERSA-N
Molecular Weight 359.473 g/mol
SMILES OCC[C@]1(c2[n](c3c(c2C[C@](N1Cc1ccccc1)(CC#N)[H])cccc3)C)[H]
SPLASH splash10-01pc-9103000000-db7d05cb24f849b8da43
Source of Spectrum KC-0-3581-0
Synonyms [(1S,3S)-2-benzyl-1-(2-hydroxyethyl)-9-methyl-2,3,4,9-tetrahydro-1H-.beta.-carbolin-3-yl]acetonitrile
Wiley ID 831963