| SpectraBase Compound ID | FEqhyOn9jB3 |
|---|---|
| InChI | InChI=1S/C10H15ClO4/c1-2-3-7-14-9(12)4-5-10(13)15-8-6-11/h4-5H,2-3,6-8H2,1H3/b5-4+ |
| InChIKey | YYWWZUYQNSOEEQ-SNAWJCMRSA-N |
| Mol Weight | 234.68 g/mol |
| Molecular Formula | C10H15ClO4 |
| Exact Mass | 234.065887 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 39NFwTHu4KE |
|---|---|
| Name | Fumaric acid, butyl 2-chloroethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 234.065886659 u |
| Formula | C10H15ClO4 |
| InChI | InChI=1S/C10H15ClO4/c1-2-3-7-14-9(12)4-5-10(13)15-8-6-11/h4-5H,2-3,6-8H2,1H3/b5-4+ |
| InChIKey | YYWWZUYQNSOEEQ-SNAWJCMRSA-N |
| Molecular Weight | 234.679 g/mol |
| SMILES | C(\C=C\C(OCCCC)=O)(OCCCl)=O |