| SpectraBase Spectrum ID |
9nR93XsrfEv |
| Name |
Succinic acid, isobutyl 2,2,2-trichloroethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
304.003592059 u |
| Formula |
C10H15Cl3O4 |
| InChI |
InChI=1S/C10H15Cl3O4/c1-7(2)5-16-8(14)3-4-9(15)17-6-10(11,12)13/h7H,3-6H2,1-2H3 |
| InChIKey |
MGZOIMXKEQGDAC-UHFFFAOYSA-N |
| Molecular Weight |
305.585 g/mol |
| SMILES |
C(CCC(OCC(Cl)(Cl)Cl)=O)(OCC(C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.837908 |
