| SpectraBase Spectrum ID |
A5Fv5BeQLsW |
| Name |
Benzamide, 4-bromo-N-(2-butyl)-N-(3-methylbutyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
325.104127396 u |
| Formula |
C16H24BrNO |
| InChI |
InChI=1S/C16H24BrNO/c1-5-13(4)18(11-10-12(2)3)16(19)14-6-8-15(17)9-7-14/h6-9,12-13H,5,10-11H2,1-4H3 |
| InChIKey |
UHYMOZWIICEIBW-UHFFFAOYSA-N |
| Molecular Weight |
326.278 g/mol |
| SMILES |
C(=O)(N(CCC(C)C)C(CC)C)C=1C=CC(=CC1)Br |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.80867 |
