| SpectraBase Spectrum ID |
743gsJAt3c1 |
| Name |
Adipic acid, monoamide, N,N-diheptyl-, decyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
481.449494761 u |
| Formula |
C30H59NO3 |
| InChI |
InChI=1S/C30H59NO3/c1-4-7-10-13-14-15-18-23-28-34-30(33)25-20-19-24-29(32)31(26-21-16-11-8-5-2)27-22-17-12-9-6-3/h4-28H2,1-3H3 |
| InChIKey |
VJMFZXSBIASSFK-UHFFFAOYSA-N |
| Molecular Weight |
481.806 g/mol |
| SMILES |
C(N(C(=O)CCCCC(OCCCCCCCCCC)=O)CCCCCCC)CCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.961039 |
