| SpectraBase Spectrum ID |
DZbwwC4DgxW |
| Name |
Succinic acid, 2-chlorophenyl 3,4-dimethylphenyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
332.081536723 u |
| Formula |
C18H17ClO4 |
| InChI |
InChI=1S/C18H17ClO4/c1-12-7-8-14(11-13(12)2)22-17(20)9-10-18(21)23-16-6-4-3-5-15(16)19/h3-8,11H,9-10H2,1-2H3 |
| InChIKey |
CRVNMWHNXOHUAI-UHFFFAOYSA-N |
| Molecular Weight |
332.783 g/mol |
| SMILES |
CC1=CC=C(C=C1C)OC(CCC(OC1=CC=CC=C1Cl)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.956779 |
