SpectraBase Spectrum ID |
CXyl5A9tG3l |
Name |
N-(4-Chlorophenyl)-2-methyl-N-(2-methylpropanoyl)propanamide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
267.102606522 u |
Formula |
C14H18ClNO2 |
InChI |
InChI=1S/C14H18ClNO2/c1-9(2)13(17)16(14(18)10(3)4)12-7-5-11(15)6-8-12/h5-10H,1-4H3 |
InChIKey |
BIMWSGVJCQFFHS-UHFFFAOYSA-N |
SMILES |
C=1(N(C(C(C)C)=O)C(C(C)C)=O)C=CC(=CC1)Cl |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.844755 |