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(S)-9-Benzyl-2-[(R)-2-hydroxy-1-phenylethyl]-1-propyl-1,2,3,4-tetrahydropyrido[3,4-b]indole
SpectraBase Compound ID KiZcDEedyLO
InChI InChI=1S/C29H32N2O/c1-2-11-27-29-25(18-19-30(27)28(21-32)23-14-7-4-8-15-23)24-16-9-10-17-26(24)31(29)20-22-12-5-3-6-13-22/h3-10,12-17,27-28,32H,2,11,18-21H2,1H3/t27-,28-/m0/s1
InChIKey PILGCVZPRAEUBW-NSOVKSMOSA-N
Mol Weight 424.6 g/mol
Molecular Formula C29H32N2O
Exact Mass 424.251464 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4hyYXeQKRM
Name (S)-9-Benzyl-2-[(R)-2-hydroxy-1-phenylethyl]-1-propyl-1,2,3,4-tetrahydropyrido[3,4-b]indole
Alternate Name(s) (2R)-2-[(1S)-9-benzyl-1-propyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl]-2-phenylethanol (2R)-2-[(1S)-9-benzyl-1-propyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl]-2-phenyl-ethanol (2R)-2-phenyl-2-[(1S)-9-(phenylmethyl)-1-propyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl]ethanol
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Formula C29H32N2O
InChI InChI=1S/C29H32N2O/c1-2-11-27-29-25(18-19-30(27)28(21-32)23-14-7-4-8-15-23)24-16-9-10-17-26(24)31(29)20-22-12-5-3-6-13-22/h3-10,12-17,27-28,32H,2,11,18-21H2,1H3/t27-,28-/m0/s1
InChIKey PILGCVZPRAEUBW-NSOVKSMOSA-N
Molecular Weight 424.588 g/mol
SMILES OC[C@@](c1ccccc1)(N1CCc2c([n](c3ccccc23)Cc2ccccc2)[C@@]1(CCC)[H])[H]
SPLASH splash10-000x-7249000000-61373e613b332b8851f3
Source of Spectrum U1-2012-1839-10c
Wiley ID 1715401