| SpectraBase Spectrum ID |
FkZ83rh7LB8 |
| Name |
Butyramide, 2-phenyl-N-propyl-N-nonyl- |
| 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/c1-4-7-8-9-10-11-15-19-23(18-5-2)22(24)21(6-3)20-16-13-12-14-17-20/h12-14,16-17,21H,4-11,15,18-19H2,1-3H3 |
| InChIKey |
ATGRSMCXCMHKAQ-UHFFFAOYSA-N |
| Molecular Weight |
331.544 g/mol |
| SMILES |
C(N(CCC)CCCCCCCCC)(=O)C(CC)C1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.941706 |
