SpectraBase Spectrum ID |
Ez6uzqUJS9Z |
Name |
Benzamide, 2-chloro-N-decyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
295.170292160 u |
Formula |
C17H26ClNO |
InChI |
InChI=1S/C17H26ClNO/c1-2-3-4-5-6-7-8-11-14-19-17(20)15-12-9-10-13-16(15)18/h9-10,12-13H,2-8,11,14H2,1H3,(H,19,20) |
InChIKey |
DHWFCIRYWTTYQL-UHFFFAOYSA-N |
Molecular Weight |
295.854 g/mol |
SMILES |
C(NCCCCCCCCCC)(=O)C=1C=CC=CC1Cl |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.875345 |