| SpectraBase Spectrum ID |
EqDOJmjaUC3 |
| Name |
Succinic acid, monoamide, N,N-dihexyl-, pentyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
355.308644181 u |
| Formula |
C21H41NO3 |
| InChI |
InChI=1S/C21H41NO3/c1-4-7-10-12-17-22(18-13-11-8-5-2)20(23)15-16-21(24)25-19-14-9-6-3/h4-19H2,1-3H3 |
| InChIKey |
PMXJYTRBSBFVKS-UHFFFAOYSA-N |
| Molecular Weight |
355.563 g/mol |
| SMILES |
C(C(=O)N(CCCCCC)CCCCCC)CC(OCCCCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.880833 |
