| SpectraBase Spectrum ID |
RiIWBoSod6 |
| Name |
Butyramide, 2-phenyl-N-(2-pentyl)-N-octadecyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
485.459665523 u |
| Formula |
C33H59NO |
| InChI |
InChI=1S/C33H59NO/c1-5-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25-29-34(30(4)26-6-2)33(35)32(7-3)31-27-23-22-24-28-31/h22-24,27-28,30,32H,5-21,25-26,29H2,1-4H3 |
| InChIKey |
GBVFIAWAQMOBBR-UHFFFAOYSA-N |
| Molecular Weight |
485.841 g/mol |
| SMILES |
C(N(CCCCCCCCCCCCCCCCCC)C(CCC)C)(=O)C(CC)C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.829769 |
