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3-(hexahydro-1H-azepin-1-yl)-3'-nitropropiophenone, hydrochloride

View entire compound with spectra: 1 FTIR, 1 Raman, and 1 UV-Vis

3-(hexahydro-1H-azepin-1-yl)-3'-nitropropiophenone, hydrochloride
SpectraBase Compound ID FIXt3sPFSTa
InChI InChI=1S/C15H20N2O3.ClH/c18-15(8-11-16-9-3-1-2-4-10-16)13-6-5-7-14(12-13)17(19)20;/h5-7,12H,1-4,8-11H2;1H
InChIKey GZSMZOZGZVJTLF-UHFFFAOYSA-N
Mol Weight 312.8 g/mol
Molecular Formula C15H21ClN2O3
Exact Mass 312.12407 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID JJBPzEcKHK8
Name 3-(HEXAHYDRO-1H-AZEPIN-1-YL)-3'-NITROPROPIOPHENONE, HYDROCHLORIDE
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H21ClN2O3
InChI InChI=1S/C15H20N2O3.ClH/c18-15(8-11-16-9-3-1-2-4-10-16)13-6-5-7-14(12-13)17(19)20;/h5-7,12H,1-4,8-11H2;1H
InChIKey GZSMZOZGZVJTLF-UHFFFAOYSA-N
Melting Point 172-174C
Molecular Weight 312.794006
Synonyms PROPIOPHENONE, 3-/HEXAHYDRO-1H- AZEPIN-1-YL/-3*-NITRO-, HYDROCHLORIDE
Technique KBr WAFER