| SpectraBase Spectrum ID |
HYziAH3hDL9 |
| Name |
Glutaric acid, myrtenyl 3-methylbut-2-en-1-yl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
334.214409442 u |
| Formula |
C20H30O4 |
| InChI |
InChI=1S/C20H30O4/c1-14(2)10-11-23-18(21)6-5-7-19(22)24-13-15-8-9-16-12-17(15)20(16,3)4/h8,10,16-17H,5-7,9,11-13H2,1-4H3 |
| InChIKey |
FBIYGECHKBFKQA-UHFFFAOYSA-N |
| Molecular Weight |
334.456 g/mol |
| SMILES |
C(CCC(OCC=C(C)C)=O)C(OCC=1C2C(C(CC1)C2)(C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.910172 |
