| SpectraBase Spectrum ID |
KCESp6Bx2h |
| Name |
Glutaric acid, monoamide, N-tetradecyl-, nonyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
453.418194632 u |
| Formula |
C28H55NO3 |
| InChI |
InChI=1S/C28H55NO3/c1-3-5-7-9-11-12-13-14-15-16-18-20-25-29-27(30)23-22-24-28(31)32-26-21-19-17-10-8-6-4-2/h3-26H2,1-2H3,(H,29,30) |
| InChIKey |
QMQGJRAYCRVAET-UHFFFAOYSA-N |
| Molecular Weight |
453.752 g/mol |
| SMILES |
CCCCCCCCCOC(CCCC(NCCCCCCCCCCCCCC)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.925711 |
