| SpectraBase Spectrum ID |
K3IcKFkxlwj |
| Name |
Benzamide, 3-chloro-N,N-dipropyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
239.107691903 u |
| Formula |
C13H18ClNO |
| InChI |
InChI=1S/C13H18ClNO/c1-3-8-15(9-4-2)13(16)11-6-5-7-12(14)10-11/h5-7,10H,3-4,8-9H2,1-2H3 |
| InChIKey |
MRHRRTXQAOTSRF-UHFFFAOYSA-N |
| Molecular Weight |
239.746 g/mol |
| SMILES |
C(N(CCC)CCC)(=O)C=1C=CC=C(Cl)C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.910004 |
