| SpectraBase Compound ID | CmxgRDJPlrP |
|---|---|
| InChI | InChI=1S/C9H13ClO3/c1-3-4-7(2)13-9(12)6-5-8(10)11/h3,7H,1,4-6H2,2H3 |
| InChIKey | LBRRWHKGDPAWTB-UHFFFAOYSA-N |
| Mol Weight | 204.65 g/mol |
| Molecular Formula | C9H13ClO3 |
| Exact Mass | 204.055322 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ed7jYKVBCdU |
|---|---|
| Name | Succinic acid, monochloride pent-4-en-2-yl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 204.055321976 u |
| Formula | C9H13ClO3 |
| InChI | InChI=1S/C9H13ClO3/c1-3-4-7(2)13-9(12)6-5-8(10)11/h3,7H,1,4-6H2,2H3 |
| InChIKey | LBRRWHKGDPAWTB-UHFFFAOYSA-N |
| Molecular Weight | 204.653 g/mol |
| SMILES | C=CCC(OC(CCC(Cl)=O)=O)C |