| SpectraBase Compound ID | AnfrXpUCO0c |
|---|---|
| InChI | InChI=1S/C15H17ClO4/c1-3-4-9-19-14(17)7-8-15(18)20-12-5-6-13(16)11(2)10-12/h3-6,10H,7-9H2,1-2H3/b4-3+ |
| InChIKey | RVRAUGUQRWCEGU-ONEGZZNKSA-N |
| Mol Weight | 296.75 g/mol |
| Molecular Formula | C15H17ClO4 |
| Exact Mass | 296.081537 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ACxv14jcnoI |
|---|---|
| Name | Succinic acid, 4-chloro-3-methylphenyl but-2-en-1-yl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 296.081536723 u |
| Formula | C15H17ClO4 |
| InChI | InChI=1S/C15H17ClO4/c1-3-4-9-19-14(17)7-8-15(18)20-12-5-6-13(16)11(2)10-12/h3-6,10H,7-9H2,1-2H3/b4-3+ |
| InChIKey | RVRAUGUQRWCEGU-ONEGZZNKSA-N |
| Molecular Weight | 296.750 g/mol |
| SMILES | C(CC(OC1=CC(C)=C(C=C1)Cl)=O)C(OC\C=C\C)=O |