SpectraBase Spectrum ID |
DHBu2XbzwKV |
Name |
Propanamide, 3-chloro-2,2-dimethyl-N-phenyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
211.076391774 u |
Formula |
C11H14ClNO |
InChI |
InChI=1S/C11H14ClNO/c1-11(2,8-12)10(14)13-9-6-4-3-5-7-9/h3-7H,8H2,1-2H3,(H,13,14) |
InChIKey |
GRKXHRAZNFTCCO-UHFFFAOYSA-N |
Molecular Weight |
211.692 g/mol |
SMILES |
N(C1=CC=CC=C1)C(C(CCl)(C)C)=O |
Spectrum/Structure Validation Score (Raman) |
0.966953 |