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(2R,3S)-2-cyano-1,3-dimethyl-N-phenyl-4,5-dihydro-2H-1-benzazepine-3-carboxamide
SpectraBase Compound ID 2zhcHxH7aX8
InChI InChI=1S/C20H21N3O/c1-20(19(24)22-16-9-4-3-5-10-16)13-12-15-8-6-7-11-17(15)23(2)18(20)14-21/h3-11,18H,12-13H2,1-2H3,(H,22,24)/t18-,20-/m0/s1
InChIKey IGGITSGGLLOKKX-ICSRJNTNSA-N
Mol Weight 319.41 g/mol
Molecular Formula C20H21N3O
Exact Mass 319.168462 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9xgWA8UwWJ7
Name (2R,3S)-2-cyano-1,3-dimethyl-N-phenyl-4,5-dihydro-2H-1-benzazepine-3-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H21N3O
InChI InChI=1S/C20H21N3O/c1-20(19(24)22-16-9-4-3-5-10-16)13-12-15-8-6-7-11-17(15)23(2)18(20)14-21/h3-11,18H,12-13H2,1-2H3,(H,22,24)/t18-,20-/m0/s1
InChIKey IGGITSGGLLOKKX-ICSRJNTNSA-N
Molecular Weight 319.408 g/mol
SMILES N(C([C@@]1([C@@](N(c2ccccc2CC1)C)(C#N)[H])C)=O)c1ccccc1
SPLASH splash10-0api-0901000000-e19c271a0c9c9c7e8331
Source of Spectrum F-49-895-10
Wiley ID 1319507