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D,L-hexahydro-2-{[1-(1-naphthyl)ethyl]imino}-1H-azepine, monohydrochloride

View entire compound with spectra: 3 NMR, and 3 FTIR

D,L-hexahydro-2-{[1-(1-naphthyl)ethyl]imino}-1H-azepine, monohydrochloride
SpectraBase Compound ID 2CDZQ5bflhX
InChI InChI=1S/C18H22N2.ClH/c1-14(20-18-12-3-2-6-13-19-18)16-11-7-9-15-8-4-5-10-17(15)16;/h4-5,7-11,14H,2-3,6,12-13H2,1H3,(H,19,20);1H
InChIKey MHAGFDAZBGXEAZ-UHFFFAOYSA-N
Mol Weight 302.85 g/mol
Molecular Formula C18H23ClN2
Exact Mass 302.154976 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID FTCgma3D80N
Name D-HEXAHYDRO-2-{[1-(1-NAPHTHYL)ETHYL]IMINO}-1H-AZEPINE, MONOHYDROCHLORIDE
Source of Sample J. M. Grisar, Merrell-National Laboratories, Cincinnati, Ohio
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H23ClN2
InChI InChI=1S/C18H22N2.ClH/c1-14(20-18-12-3-2-6-13-19-18)16-11-7-9-15-8-4-5-10-17(15)16;/h4-5,7-11,14H,2-3,6,12-13H2,1H3,(H,19,20);1H
InChIKey MHAGFDAZBGXEAZ-UHFFFAOYSA-N
Literature Reference J. MED. CHEM. 15, 1270(1972)
Melting Point 252-253C
Molecular Weight 302.846008
Synonyms 1H-AZEPINE, HEXAHYDRO- 2-//1-/1-NAPHTHYL/ETHYL/IMINO/-, MONO- HYDROCHLORIDE, D-,
Technique KBr WAFER