SpectraBase Spectrum ID |
4p6rDlgAgjY |
Name |
Propanamide, N-(3-methylphenyl)-2-chloro- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
197.060741709 u |
Formula |
C10H12ClNO |
InChI |
InChI=1S/C10H12ClNO/c1-7-4-3-5-9(6-7)12-10(13)8(2)11/h3-6,8H,1-2H3,(H,12,13) |
InChIKey |
VOVIUZVPOZODGY-UHFFFAOYSA-N |
Molecular Weight |
197.665 g/mol |
SMILES |
C(Cl)(C)C(=O)NC1=CC(C)=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.84798 |