SpectraBase Spectrum ID |
I5fDqpAYt0g |
Name |
Benzamide, 3-methyl-N-heptyl- |
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/c1-3-4-5-6-7-11-16-15(17)14-10-8-9-13(2)12-14/h8-10,12H,3-7,11H2,1-2H3,(H,16,17) |
InChIKey |
OYABQGPEXFSLEK-UHFFFAOYSA-N |
Molecular Weight |
233.355 g/mol |
SMILES |
C(NCCCCCCC)(=O)C=1C=CC=C(C)C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.970926 |