| SpectraBase Compound ID | 5Eh8e4ES9G7 |
|---|---|
| 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 |
| Mol Weight | 332.78 g/mol |
| Molecular Formula | C18H17ClO4 |
| Exact Mass | 332.081537 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GfqrgZ5t1ng |
|---|---|
| Name | Succinic acid, 2-chlorophenyl 3,4-dimethylphenyl ester |
| Comments | Computed using HOSE algorithm |
| 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 |