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7-(4-Chlorophenyl)-5-methoxy-1-methyl-1H-azepin-2(3H)-one

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

7-(4-Chlorophenyl)-5-methoxy-1-methyl-1H-azepin-2(3H)-one
SpectraBase Compound ID CBc4lh6oaZx
InChI InChI=1S/C14H14ClNO2/c1-16-13(10-3-5-11(15)6-4-10)9-12(18-2)7-8-14(16)17/h3-7,9H,8H2,1-2H3
InChIKey ZYSYVKJUZGSJGI-UHFFFAOYSA-N
Mol Weight 263.72 g/mol
Molecular Formula C14H14ClNO2
Exact Mass 263.071306 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 4awbxCVeUos
Name 7-(4-Chlorophenyl)-5-methoxy-1-methyl-1H-azepin-2(3H)-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 263.071306393 u
Formula C14H14ClNO2
InChI InChI=1S/C14H14ClNO2/c1-16-13(10-3-5-11(15)6-4-10)9-12(18-2)7-8-14(16)17/h3-7,9H,8H2,1-2H3
InChIKey ZYSYVKJUZGSJGI-UHFFFAOYSA-N
SMILES C1(N(C(=CC(=CC1)OC)C=1C=CC(=CC1)Cl)C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.943288