| SpectraBase Spectrum ID |
Ff4hwMCecEz |
| Name |
Glutaric acid, monoamide, N-(4-methylbenzyl)-, tetradecyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
431.339944310 u |
| Formula |
C27H45NO3 |
| InChI |
InChI=1S/C27H45NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-22-31-27(30)17-15-16-26(29)28-23-25-20-18-24(2)19-21-25/h18-21H,3-17,22-23H2,1-2H3,(H,28,29) |
| InChIKey |
RWEVFGQFGDLGES-UHFFFAOYSA-N |
| Molecular Weight |
431.661 g/mol |
| SMILES |
CCCCCCCCCCCCCCOC(CCCC(NCC1=CC=C(C=C1)C)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.864168 |
