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2-[(2,2-Diphenyl-1-methylpropyl)imino]hexahydro-1H-azepine, monohydrochloride
SpectraBase Compound ID 6G35sMLC2lD
InChI InChI=1S/C22H28N2.ClH/c1-18(24-21-16-10-5-11-17-23-21)22(2,19-12-6-3-7-13-19)20-14-8-4-9-15-20;/h3-4,6-9,12-15,18H,5,10-11,16-17H2,1-2H3,(H,23,24);1H
InChIKey OMMFKAHWLBBWRV-UHFFFAOYSA-N
Mol Weight 356.94 g/mol
Molecular Formula C22H29ClN2
Exact Mass 356.201927 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID Eqy2vmCfz92
Name 2-[(2,2-Diphenyl-1-methylpropyl)imino]hexahydro-1H-azepine, monohydrochloride
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 356.201926642 u
Formula C22H29ClN2
InChI InChI=1S/C22H28N2.ClH/c1-18(24-21-16-10-5-11-17-23-21)22(2,19-12-6-3-7-13-19)20-14-8-4-9-15-20;/h3-4,6-9,12-15,18H,5,10-11,16-17H2,1-2H3,(H,23,24);1H
InChIKey OMMFKAHWLBBWRV-UHFFFAOYSA-N
Molecular Weight 356.941 g/mol
SMILES Cl.N1CCCCC\C1=N/C(C)C(C=1C=CC=CC1)(C=1C=CC=CC1)C
Spectrum/Structure Validation Score (Raman) 0.994849