| SpectraBase Spectrum ID |
4jq6IRCHt2E |
| Name |
N-(5,5-Dimethylhex-1-en-4-yl)benzamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
231.162314299 u |
| Formula |
C15H21NO |
| InChI |
InChI=1S/C15H21NO/c1-5-9-13(15(2,3)4)16-14(17)12-10-7-6-8-11-12/h5-8,10-11,13H,1,9H2,2-4H3,(H,16,17) |
| InChIKey |
BXPZBRUJLNOEFB-UHFFFAOYSA-N |
| Molecular Weight |
231.339 g/mol |
| SMILES |
C(NC(C(C)(C)C)CC=C)(=O)C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.947474 |
