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2-{[α-(4-fluoro-1-naphthyl)benzyl]imino}hexahydro-1H-azepine, monohydrochloride
SpectraBase Compound ID 5A4iJM5qmCq
InChI InChI=1S/C23H23FN2.ClH/c24-21-15-14-20(18-11-6-7-12-19(18)21)23(17-9-3-1-4-10-17)26-22-13-5-2-8-16-25-22;/h1,3-4,6-7,9-12,14-15,23H,2,5,8,13,16H2,(H,25,26);1H
InChIKey GSMZVKUCPNOTCN-UHFFFAOYSA-N
Mol Weight 382.91 g/mol
Molecular Formula C23H24ClFN2
Exact Mass 382.161205 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID KtfbSdazJb5
Name 2-{[alpha-(4-FLUORO-1-NAPHTHYL)BENZYL]IMINO}HEXAHYDRO-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 C23H24ClFN2
InChI InChI=1S/C23H23FN2.ClH/c24-21-15-14-20(18-11-6-7-12-19(18)21)23(17-9-3-1-4-10-17)26-22-13-5-2-8-16-25-22;/h1,3-4,6-7,9-12,14-15,23H,2,5,8,13,16H2,(H,25,26);1H
InChIKey GSMZVKUCPNOTCN-UHFFFAOYSA-N
Literature Reference J. MED. CHEM. 15, 1270(1972)
Melting Point 278-279C
Molecular Weight 382.908997
Synonyms 1H-AZEPINE, 2-//A-/4-FLUORO- 1-NAPHTHYL/BENZYL/IMINO/HEXAHYDRO-, MONOHYDROCHLORIDE
Technique KBr WAFER