SpectraBase Spectrum ID |
ikI4ftH6su |
Name |
N-(1-(3-Methoxy-4-methylphenyl)butan-2-yl)acetamide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
235.157228918 u |
Formula |
C14H21NO2 |
InChI |
InChI=1S/C14H21NO2/c1-5-13(15-11(3)16)8-12-7-6-10(2)14(9-12)17-4/h6-7,9,13H,5,8H2,1-4H3,(H,15,16) |
InChIKey |
WLZCHERPPSLEGG-UHFFFAOYSA-N |
Molecular Weight |
235.327 g/mol |
SMILES |
C1=C(C(=CC(=C1)CC(NC(C)=O)CC)OC)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.950727 |