| SpectraBase Spectrum ID |
L0PX9tzO7zv |
| Name |
Glutaric acid, 2,7-dimethyloct-5-yn-7-en-4-yl octyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
378.277009700 u |
| Formula |
C23H38O4 |
| InChI |
InChI=1S/C23H38O4/c1-6-7-8-9-10-11-17-26-22(24)13-12-14-23(25)27-21(18-20(4)5)16-15-19(2)3/h20-21H,2,6-14,17-18H2,1,3-5H3 |
| InChIKey |
HSYSXPNEFJQHMA-UHFFFAOYSA-N |
| Molecular Weight |
378.553 g/mol |
| SMILES |
CC(CC(OC(CCCC(OCCCCCCCC)=O)=O)C#CC(=C)C)C |
