| SpectraBase Spectrum ID |
BJZgeGFgnPB |
| Name |
Pent-4-enoylamide, 2-methyl-N-(2-pentyl)-N-dodecyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
351.350115072 u |
| Formula |
C23H45NO |
| InChI |
InChI=1S/C23H45NO/c1-6-9-10-11-12-13-14-15-16-17-20-24(22(5)19-8-3)23(25)21(4)18-7-2/h7,21-22H,2,6,8-20H2,1,3-5H3 |
| InChIKey |
DWJRMETTYLLQFW-UHFFFAOYSA-N |
| Molecular Weight |
351.619 g/mol |
| SMILES |
C(N(CCCCCCCCCCCC)C(CCC)C)(=O)C(C)CC=C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.922311 |
