| SpectraBase Spectrum ID |
HXUZTijmB2J |
| Name |
Sebacic acid, 3,5-dichlorophenyl isohexyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
430.167764906 u |
| Formula |
C22H32Cl2O4 |
| InChI |
InChI=1S/C22H32Cl2O4/c1-17(2)10-9-13-27-21(25)11-7-5-3-4-6-8-12-22(26)28-20-15-18(23)14-19(24)16-20/h14-17H,3-13H2,1-2H3 |
| InChIKey |
HYPGBYQESQUTSI-UHFFFAOYSA-N |
| Molecular Weight |
431.400 g/mol |
| SMILES |
C(CCCCC(OC1=CC(=CC(=C1)Cl)Cl)=O)CCCC(OCCCC(C)C)=O |
