| SpectraBase Spectrum ID |
KcTwLMIcsbi |
| Name |
Benzamide, 3-methyl-N-(2-pentyl)-N-hexadecyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
429.397065265 u |
| Formula |
C29H51NO |
| InChI |
InChI=1S/C29H51NO/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-24-30(27(4)21-6-2)29(31)28-23-20-22-26(3)25-28/h20,22-23,25,27H,5-19,21,24H2,1-4H3 |
| InChIKey |
WWFVFTWJFYKALA-UHFFFAOYSA-N |
| Molecular Weight |
429.733 g/mol |
| SMILES |
C(N(CCCCCCCCCCCCCCCC)C(CCC)C)(=O)C=1C=C(C=CC1)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.873147 |
