| SpectraBase Spectrum ID |
EWNJi7zJkX0 |
| Name |
Benzamide, 4-tert-butyl-N-propyl-N-(2-ethylhexyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
331.287514814 u |
| Formula |
C22H37NO |
| InChI |
InChI=1S/C22H37NO/c1-7-10-11-18(9-3)17-23(16-8-2)21(24)19-12-14-20(15-13-19)22(4,5)6/h12-15,18H,7-11,16-17H2,1-6H3 |
| InChIKey |
HXFKFRLVPOEQNU-UHFFFAOYSA-N |
| Molecular Weight |
331.544 g/mol |
| SMILES |
C1(=CC=C(C=C1)C(N(CCC)CC(CCCC)CC)=O)C(C)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.925829 |
