SpectraBase Spectrum ID |
CZLwDWTm3GM |
Name |
Propanamide, N-(4-methoxyphenyl)-2-chloro- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
213.055656328 u |
Formula |
C10H12ClNO2 |
InChI |
InChI=1S/C10H12ClNO2/c1-7(11)10(13)12-8-3-5-9(14-2)6-4-8/h3-7H,1-2H3,(H,12,13) |
InChIKey |
DGAWNIKUBVWNHS-UHFFFAOYSA-N |
Molecular Weight |
213.664 g/mol |
SMILES |
C(Cl)(C)C(=O)NC1=CC=C(OC)C=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.929394 |