| SpectraBase Spectrum ID |
6XIcJ7IgNwK |
| Name |
Glutaric acid, myrtenyl 3-methylbut-2-yl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
336.230059506 u |
| Formula |
C20H32O4 |
| InChI |
InChI=1S/C20H32O4/c1-13(2)14(3)24-19(22)8-6-7-18(21)23-12-15-9-10-16-11-17(15)20(16,4)5/h9,13-14,16-17H,6-8,10-12H2,1-5H3 |
| InChIKey |
IJSKQCHCEDUKJI-UHFFFAOYSA-N |
| Molecular Weight |
336.472 g/mol |
| SMILES |
C(CCC(OC(C(C)C)C)=O)C(OCC=1C2C(C(CC1)C2)(C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.961423 |
