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(S)-1,5-Dimethyl-3-(R)-methyl-3-phenylamino-2,3,4,5-tetrahydro-1H-benzo[b]azepine-2-carbonitrile
SpectraBase Compound ID JEptviYbAKR
InChI InChI=1S/C20H23N3/c1-15-13-20(2,22-16-9-5-4-6-10-16)19(14-21)23(3)18-12-8-7-11-17(15)18/h4-12,15,19,22H,13H2,1-3H3/t15-,19?,20+/m0/s1
InChIKey QNPWRCDXPZFOIK-DVLXCBSQSA-N
Mol Weight 305.42 g/mol
Molecular Formula C20H23N3
Exact Mass 305.189198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 662GuECw20R
Name (S)-1,5-Dimethyl-3-(R)-methyl-3-phenylamino-2,3,4,5-tetrahydro-1H-benzo[b]azepine-2-carbonitrile
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Formula C20H23N3
InChI InChI=1S/C20H23N3/c1-15-13-20(2,22-16-9-5-4-6-10-16)19(14-21)23(3)18-12-8-7-11-17(15)18/h4-12,15,19,22H,13H2,1-3H3/t15-,19?,20+/m0/s1
InChIKey QNPWRCDXPZFOIK-DVLXCBSQSA-N
Molecular Weight 305.425 g/mol
SMILES N([C@]1(C(N(c2c([C@](C)([H])C1)cccc2)C)C#N)C)c1ccccc1
SPLASH splash10-05fr-0901000000-a18e8a7bc3d4ef25e4cf
Source of Spectrum AC-134-533-15
Synonyms (3R,5S)-3-anilino-1,3,5-trimethyl-2,3,4,5-tetrahydro-1H-1-benzazepine-2-carbonitrile 1,3,4,5-Tetramethyl-2-cyano-3-(phenylamino)benzazepine 1,3,5-Trimethyl-2-cyano-3-(phenylamino)benzazepan
Wiley ID 812549