| SpectraBase Compound ID | IbEUHeNBIuM |
|---|---|
| InChI | InChI=1S/C12H12Cl2O4/c13-7-8-17-11(15)5-6-12(16)18-10-4-2-1-3-9(10)14/h1-4H,5-8H2 |
| InChIKey | HMFXHQHRCNNEOF-UHFFFAOYSA-N |
| Mol Weight | 291.13 g/mol |
| Molecular Formula | C12H12Cl2O4 |
| Exact Mass | 290.011264 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | KdxAQRxBeaH |
|---|---|
| Name | Succinic acid, 2-chlorophenyl 2-chloroethyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 290.011264262 u |
| Formula | C12H12Cl2O4 |
| InChI | InChI=1S/C12H12Cl2O4/c13-7-8-17-11(15)5-6-12(16)18-10-4-2-1-3-9(10)14/h1-4H,5-8H2 |
| InChIKey | HMFXHQHRCNNEOF-UHFFFAOYSA-N |
| SMILES | C(COC(CCC(OC1=CC=CC=C1Cl)=O)=O)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.874341 |