| SpectraBase Spectrum ID |
LClR2qy5Ajf |
| Name |
Glutaric acid, ethyl neryl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
296.198759378 u |
| Formula |
C17H28O4 |
| InChI |
InChI=1S/C17H28O4/c1-5-20-16(18)10-7-11-17(19)21-13-12-15(4)9-6-8-14(2)3/h8,12H,5-7,9-11,13H2,1-4H3/b15-12- |
| InChIKey |
HKXDZRFCGLNFGT-QINSGFPZSA-N |
| Molecular Weight |
296.407 g/mol |
| SMILES |
C(CCC(OCC)=O)C(OC\C=C\(C)CCC=C(C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.951759 |
