SpectraBase Spectrum ID |
1MQIbmMUsfr |
Name |
Propionamide, 3-chloro-N-propyl-N-(3-methylbutyl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
219.138992031 u |
Formula |
C11H22ClNO |
InChI |
InChI=1S/C11H22ClNO/c1-4-8-13(9-6-10(2)3)11(14)5-7-12/h10H,4-9H2,1-3H3 |
InChIKey |
JXSKHQRGVDYWSU-UHFFFAOYSA-N |
Molecular Weight |
219.756 g/mol |
SMILES |
C(=O)(N(CCC)CCC(C)C)CCCl |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.88894 |