SpectraBase Spectrum ID |
FrCppmvJbJl |
Name |
N-(2-Hydroxyethyl)-2-(4-isobutylphenyl)propanamide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
249.172878983 u |
Formula |
C15H23NO2 |
InChI |
InChI=1S/C15H23NO2/c1-11(2)10-13-4-6-14(7-5-13)12(3)15(18)16-8-9-17/h4-7,11-12,17H,8-10H2,1-3H3,(H,16,18) |
InChIKey |
JVGUNCHERKJFCM-UHFFFAOYSA-N |
Molecular Weight |
249.354 g/mol |
SMILES |
C(NC(=O)C(C)C1=CC=C(C=C1)CC(C)C)CO |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.928174 |