| SpectraBase Spectrum ID |
AsATXeHVHJ4 |
| Name |
Eicosanoylamide, N-allyl-N-(hept-2-yl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
449.459665523 u |
| Formula |
C30H59NO |
| InChI |
InChI=1S/C30H59NO/c1-5-8-10-11-12-13-14-15-16-17-18-19-20-21-22-23-25-27-30(32)31(28-7-3)29(4)26-24-9-6-2/h7,29H,3,5-6,8-28H2,1-2,4H3 |
| InChIKey |
OKDCYLIPNGAIBV-UHFFFAOYSA-N |
| Molecular Weight |
449.808 g/mol |
| SMILES |
C(N(C(CCCCC)C)CC=C)(=O)CCCCCCCCCCCCCCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.894707 |
