SpectraBase Spectrum ID |
8FEqk1lh4p9 |
Name |
Benzamide, 2-methoxy-N-heptyl- |
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/c1-3-4-5-6-9-12-16-15(17)13-10-7-8-11-14(13)18-2/h7-8,10-11H,3-6,9,12H2,1-2H3,(H,16,17) |
InChIKey |
JXANSZLOODHJAL-UHFFFAOYSA-N |
Molecular Weight |
249.354 g/mol |
SMILES |
C1=C(C(=CC=C1)C(NCCCCCCC)=O)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.964603 |