| SpectraBase Spectrum ID |
8o772HaURak |
| Name |
Succinic acid, 2,2-dichloroethyl 2,4,4-trimethylpentyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
326.105164649 u |
| Formula |
C14H24Cl2O4 |
| InChI |
InChI=1S/C14H24Cl2O4/c1-10(7-14(2,3)4)8-19-12(17)5-6-13(18)20-9-11(15)16/h10-11H,5-9H2,1-4H3 |
| InChIKey |
BSRXMLQQEATODU-UHFFFAOYSA-N |
| Molecular Weight |
327.248 g/mol |
| SMILES |
C(CC(OCC(Cl)Cl)=O)C(OCC(C)CC(C)(C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.976697 |
