| SpectraBase Spectrum ID |
FuIIDMz8oFB |
| Name |
Sebacic acid, 2,3-dichlorophenyl isobutyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
402.136464778 u |
| Formula |
C20H28Cl2O4 |
| InChI |
InChI=1S/C20H28Cl2O4/c1-15(2)14-25-18(23)12-7-5-3-4-6-8-13-19(24)26-17-11-9-10-16(21)20(17)22/h9-11,15H,3-8,12-14H2,1-2H3 |
| InChIKey |
HGTFVSWLZGKKPM-UHFFFAOYSA-N |
| Molecular Weight |
403.346 g/mol |
| SMILES |
C(CCCCCC(OC1=C(C(=CC=C1)Cl)Cl)=O)CCC(OCC(C)C)=O |
