| SpectraBase Spectrum ID |
E2orOAUFZLg |
| Name |
Benzamide, 3-methyl-N-(2-butyl)-N-heptyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
289.240564621 u |
| Formula |
C19H31NO |
| InChI |
InChI=1S/C19H31NO/c1-5-7-8-9-10-14-20(17(4)6-2)19(21)18-13-11-12-16(3)15-18/h11-13,15,17H,5-10,14H2,1-4H3 |
| InChIKey |
NZNBKTGVYHYJDE-UHFFFAOYSA-N |
| Molecular Weight |
289.463 g/mol |
| SMILES |
C(N(CCCCCCC)C(CC)C)(=O)C=1C=C(C=CC1)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.930818 |
