| SpectraBase Spectrum ID |
BCkkPKVN8cA |
| Name |
Benzamide, 2,4-dichloro-N-(2-pentyl)-N-butyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
315.115669764 u |
| Formula |
C16H23Cl2NO |
| InChI |
InChI=1S/C16H23Cl2NO/c1-4-6-10-19(12(3)7-5-2)16(20)14-9-8-13(17)11-15(14)18/h8-9,11-12H,4-7,10H2,1-3H3 |
| InChIKey |
VMVRJXJFSCYQNT-UHFFFAOYSA-N |
| Molecular Weight |
316.272 g/mol |
| SMILES |
CCCC(N(C(=O)C=1C(=CC(=CC1)Cl)Cl)CCCC)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.913032 |
