SpectraBase Spectrum ID |
2sblqEdcP3Q |
Name |
Acetamide, 2-(4-methoxyphenyl)-N-(2-pentyl)-N-isobutyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
291.219829176 u |
Formula |
C18H29NO2 |
InChI |
InChI=1S/C18H29NO2/c1-6-7-15(4)19(13-14(2)3)18(20)12-16-8-10-17(21-5)11-9-16/h8-11,14-15H,6-7,12-13H2,1-5H3 |
InChIKey |
WPUNUTBZVJHZRW-UHFFFAOYSA-N |
SMILES |
C(N(CC(C)C)C(CCC)C)(=O)CC=1C=CC(OC)=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.916216 |