| SpectraBase Spectrum ID |
65uz8Bqvswu |
| Name |
Benzamide, 4-methyl-N-(2-pentyl)-N-isobutyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
261.209264492 u |
| Formula |
C17H27NO |
| InChI |
InChI=1S/C17H27NO/c1-6-7-15(5)18(12-13(2)3)17(19)16-10-8-14(4)9-11-16/h8-11,13,15H,6-7,12H2,1-5H3 |
| InChIKey |
PEKXZYVNXRRMGE-UHFFFAOYSA-N |
| Molecular Weight |
261.409 g/mol |
| SMILES |
C1=CC(=CC=C1C(N(CC(C)C)C(CCC)C)=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.934538 |
