| SpectraBase Spectrum ID |
Ii67Xqv83Ax |
| Name |
Benzamide, 2-bromo-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 |
311.088477331 u |
| Formula |
C15H22BrNO |
| InChI |
InChI=1S/C15H22BrNO/c1-4-10-17(11-9-12(2)3)15(18)13-7-5-6-8-14(13)16/h5-8,12H,4,9-11H2,1-3H3 |
| InChIKey |
BMNPSHUDFLOKLQ-UHFFFAOYSA-N |
| Molecular Weight |
312.251 g/mol |
| SMILES |
C(=O)(N(CCC)CCC(C)C)C=1C=CC=CC1Br |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.827103 |
