| SpectraBase Spectrum ID |
7cYxe6EzZkp |
| Name |
Glutaric acid, 2,3-dichlorophenyl 3,7-dimethyloctyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
416.152114842 u |
| Formula |
C21H30Cl2O4 |
| InChI |
InChI=1S/C21H30Cl2O4/c1-15(2)7-4-8-16(3)13-14-26-19(24)11-6-12-20(25)27-18-10-5-9-17(22)21(18)23/h5,9-10,15-16H,4,6-8,11-14H2,1-3H3 |
| InChIKey |
LUESKPZWMBPICL-UHFFFAOYSA-N |
| Molecular Weight |
417.373 g/mol |
| SMILES |
C(CCC(OC1=C(C(=CC=C1)Cl)Cl)=O)C(OCCC(CCCC(C)C)C)=O |
