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N-(2-Chloroethyl)-N-[(4-methoxypheny)methyl]phenylacetamide
SpectraBase Compound ID 9yCwcin5430
InChI InChI=1S/C18H20ClNO2/c1-22-17-9-7-16(8-10-17)14-20(12-11-19)18(21)13-15-5-3-2-4-6-15/h2-10H,11-14H2,1H3
InChIKey IZUXDTLUDJTWQH-UHFFFAOYSA-N
Mol Weight 317.82 g/mol
Molecular Formula C18H20ClNO2
Exact Mass 317.118257 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 2AyR3mLPVFg
Name N-(2-Chloroethyl)-N-[(4-methoxypheny)methyl]phenylacetamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 317.118256586 u
Formula C18H20ClNO2
InChI InChI=1S/C18H20ClNO2/c1-22-17-9-7-16(8-10-17)14-20(12-11-19)18(21)13-15-5-3-2-4-6-15/h2-10H,11-14H2,1H3
InChIKey IZUXDTLUDJTWQH-UHFFFAOYSA-N
Molecular Weight 317.816 g/mol
SMILES C1(=CC=CC=C1)CC(N(CC1=CC=C(C=C1)OC)CCCl)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.933672