SpectraBase Spectrum ID |
6pEuPY1PhKI |
Name |
Succinic acid, 2,2-dichloroethyl 2-methoxyphenyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
320.021828946 u |
Formula |
C13H14Cl2O5 |
InChI |
InChI=1S/C13H14Cl2O5/c1-18-9-4-2-3-5-10(9)20-13(17)7-6-12(16)19-8-11(14)15/h2-5,11H,6-8H2,1H3 |
InChIKey |
ZJBCUYULBUQEJP-UHFFFAOYSA-N |
Molecular Weight |
321.156 g/mol |
SMILES |
C(CC(OCC(Cl)Cl)=O)C(OC1=CC=CC=C1OC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.956135 |