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N-(2',5'-Dimethoxyphenyl)-3-chloropropanamide

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

N-(2',5'-Dimethoxyphenyl)-3-chloropropanamide
SpectraBase Compound ID FOfdo4CExco
InChI InChI=1S/C11H14ClNO3/c1-15-8-3-4-10(16-2)9(7-8)13-11(14)5-6-12/h3-4,7H,5-6H2,1-2H3,(H,13,14)
InChIKey QLZAYTWEEVKOOY-UHFFFAOYSA-N
Mol Weight 243.69 g/mol
Molecular Formula C11H14ClNO3
Exact Mass 243.066221 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 1wIW6jV5xed
Name N-(2',5'-Dimethoxyphenyl)-3-chloropropanamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 243.066221012 u
Formula C11H14ClNO3
InChI InChI=1S/C11H14ClNO3/c1-15-8-3-4-10(16-2)9(7-8)13-11(14)5-6-12/h3-4,7H,5-6H2,1-2H3,(H,13,14)
InChIKey QLZAYTWEEVKOOY-UHFFFAOYSA-N
Molecular Weight 243.690 g/mol
SMILES C(Cl)CC(=O)NC1=C(OC)C=CC(OC)=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.87972