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3-ethylhexahydro-3-(m-methoxyphenyl)-1-methyl-2H-azepin-2-one

View entire compound with spectra: 2 NMR, and 1 FTIR

3-ethylhexahydro-3-(m-methoxyphenyl)-1-methyl-2H-azepin-2-one
SpectraBase Compound ID I3nk8vkcY27
InChI InChI=1S/C16H23NO2/c1-4-16(10-5-6-11-17(2)15(16)18)13-8-7-9-14(12-13)19-3/h7-9,12H,4-6,10-11H2,1-3H3
InChIKey AFBQUXAODCBPRJ-UHFFFAOYSA-N
Mol Weight 261.36 g/mol
Molecular Formula C16H23NO2
Exact Mass 261.172879 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID EboJs5Q5lRP
Name 3-ETHYLHEXAHYDRO-3-(m-METHOXYPHENYL)-1-METHYL-2H-AZEPIN-2-ONE
Source of Sample A. C. WHITE, WYETH LABORATORIES, BERKSHIRE, ENGLAND
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H23NO2
InChI InChI=1S/C16H23NO2/c1-4-16(10-5-6-11-17(2)15(16)18)13-8-7-9-14(12-13)19-3/h7-9,12H,4-6,10-11H2,1-3H3
InChIKey AFBQUXAODCBPRJ-UHFFFAOYSA-N
Literature Reference EUR. J. MED. CHEM. 15, 375(1980)
Melting Point 68-69C
Molecular Weight 261.364990
Synonyms 2H-AZEPIN-2-ONE, 3-ETHYLHEXAHYDRO- 3-/M-METHOXYPHENYL/-1-METHYL-,
Technique KBr WAFER