| SpectraBase Spectrum ID |
4yObJbrhu3B |
| Name |
Benzamide, 3-methoxy-N-(3-methylbutyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
221.141578854 u |
| Formula |
C13H19NO2 |
| InChI |
InChI=1S/C13H19NO2/c1-10(2)7-8-14-13(15)11-5-4-6-12(9-11)16-3/h4-6,9-10H,7-8H2,1-3H3,(H,14,15) |
| InChIKey |
PJLGWJKFLSHQLH-UHFFFAOYSA-N |
| Molecular Weight |
221.300 g/mol |
| SMILES |
C(NCCC(C)C)(=O)C=1C=CC=C(OC)C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.840762 |
