| SpectraBase Spectrum ID |
IIGiVZjYoYv |
| Name |
Succinic acid, 2,2-dichloroethyl 3-pentyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
284.058214456 u |
| Formula |
C11H18Cl2O4 |
| InChI |
InChI=1S/C11H18Cl2O4/c1-3-8(4-2)17-11(15)6-5-10(14)16-7-9(12)13/h8-9H,3-7H2,1-2H3 |
| InChIKey |
WKSHUHNWABXYIO-UHFFFAOYSA-N |
| Molecular Weight |
285.167 g/mol |
| SMILES |
C(COC(=O)CCC(OC(CC)CC)=O)(Cl)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.98013 |
