SpectraBase Spectrum ID |
7qRgp4agybj |
Name |
N-Normal-heptyl-(4-methoxyphenyl)-acetamide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
263.188529047 u |
Formula |
C16H25NO2 |
InChI |
InChI=1S/C16H25NO2/c1-3-4-5-6-7-12-17-16(18)13-14-8-10-15(19-2)11-9-14/h8-11H,3-7,12-13H2,1-2H3,(H,17,18) |
InChIKey |
IPUPOLXJVYLIOX-UHFFFAOYSA-N |
Molecular Weight |
263.381 g/mol |
SMILES |
C(=O)(CC1=CC=C(OC)C=C1)NCCCCCCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.955372 |