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hexahydro-2-[(trans-2-phenylcyclohexyl)imino]-1H-azepine, monohydrochloride

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hexahydro-2-[(trans-2-phenylcyclohexyl)imino]-1H-azepine, monohydrochloride
SpectraBase Compound ID EnyVhpEDARp
InChI InChI=1S/C18H26N2.ClH/c1-3-9-15(10-4-1)16-11-6-7-12-17(16)20-18-13-5-2-8-14-19-18;/h1,3-4,9-10,16-17H,2,5-8,11-14H2,(H,19,20);1H/t16-,17+;/s2
InChIKey ZPOVKUDWJOALER-BUROELJPSA-N
Mol Weight 306.88 g/mol
Molecular Formula C18H27ClN2
Exact Mass 306.186277 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 19xNSddRZeJ
Name HEXAHYDRO-2-[(trans-2-PHENYLCYCLOHEXYL)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 C18H27ClN2
InChI InChI=1S/C18H26N2.ClH/c1-3-9-15(10-4-1)16-11-6-7-12-17(16)20-18-13-5-2-8-14-19-18;/h1,3-4,9-10,16-17H,2,5-8,11-14H2,(H,19,20);1H/t16-,17+;/s2
InChIKey ZPOVKUDWJOALER-BUROELJPSA-N
Literature Reference J. MED. CHEM. 16, 679(1973)
Melting Point 236-239C
Molecular Weight 306.877991
Synonyms 1H-AZEPINE, HEXAHYDRO-2-//TRANS- 2-PHENYLCYCLOHEXYL/IMINO-, MONOHYDRO- CHLORIDE
Technique KBr WAFER