| SpectraBase Spectrum ID |
LG5WtThkjyq |
| Name |
Glutaric acid, monoamide, N-(2-octyl)-, hexyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
327.277344052 u |
| Formula |
C19H37NO3 |
| InChI |
InChI=1S/C19H37NO3/c1-4-6-8-10-13-17(3)20-18(21)14-12-15-19(22)23-16-11-9-7-5-2/h17H,4-16H2,1-3H3,(H,20,21) |
| InChIKey |
DOADKABPBYPGME-UHFFFAOYSA-N |
| Molecular Weight |
327.509 g/mol |
| SMILES |
CC(NC(CCCC(OCCCCCC)=O)=O)CCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.963445 |
