SpectraBase Spectrum ID |
APmCoimYySb |
Name |
Propionamide, 2,3-dichloro-N-2-ethylhexyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
253.100019699 u |
Formula |
C11H21Cl2NO |
InChI |
InChI=1S/C11H21Cl2NO/c1-3-5-6-9(4-2)8-14-11(15)10(13)7-12/h9-10H,3-8H2,1-2H3,(H,14,15) |
InChIKey |
LXFBOZXJIOYERU-UHFFFAOYSA-N |
Molecular Weight |
254.201 g/mol |
SMILES |
C(C(=O)NCC(CCCC)CC)(CCl)Cl |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.969138 |