| SpectraBase Spectrum ID |
9gX4jmT73KL |
| Name |
but-2-Enoic acid, amide, 3-methyl-N-(2-ethylphenyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
203.131014170 u |
| Formula |
C13H17NO |
| InChI |
InChI=1S/C13H17NO/c1-4-11-7-5-6-8-12(11)14-13(15)9-10(2)3/h5-9H,4H2,1-3H3,(H,14,15) |
| InChIKey |
WVPMPVDSVJDKDF-UHFFFAOYSA-N |
| Molecular Weight |
203.285 g/mol |
| SMILES |
C(=C(C)C)C(=O)NC=1C(CC)=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.945657 |
