SpectraBase Spectrum ID |
6ZaENWSN1CS |
Name |
Propionamide, 3-chloro-N-hexadecyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
331.264192547 u |
Formula |
C19H38ClNO |
InChI |
InChI=1S/C19H38ClNO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-21-19(22)16-17-20/h2-18H2,1H3,(H,21,22) |
InChIKey |
NQEOONFWRGTVSN-UHFFFAOYSA-N |
Molecular Weight |
331.972 g/mol |
SMILES |
C(CCCl)(NCCCCCCCCCCCCCCCC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.80947 |