SpectraBase Spectrum ID |
W6P0TZ4SQ3 |
Name |
Acetamide, 2-phenyl-N-propyl-N-isobutyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
233.177964364 u |
Formula |
C15H23NO |
InChI |
InChI=1S/C15H23NO/c1-4-10-16(12-13(2)3)15(17)11-14-8-6-5-7-9-14/h5-9,13H,4,10-12H2,1-3H3 |
InChIKey |
UHSGDSSHDDNMCY-UHFFFAOYSA-N |
Molecular Weight |
233.355 g/mol |
SMILES |
C(C(N(CC(C)C)CCC)=O)C=1C=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.901143 |