| SpectraBase Compound ID | FIyNGx3EJ5a |
|---|---|
| InChI | InChI=1S/C15H19ClO4/c1-3-4-9-19-14(17)7-8-15(18)20-12-5-6-13(16)11(2)10-12/h5-6,10H,3-4,7-9H2,1-2H3 |
| InChIKey | ZSPZYDNCBMLVLY-UHFFFAOYSA-N |
| Mol Weight | 298.77 g/mol |
| Molecular Formula | C15H19ClO4 |
| Exact Mass | 298.097187 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BWtP7BVZeaE |
|---|---|
| Name | Succinic acid, butyl 4-CHLORO3-methylphenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 298.097186788 u |
| Formula | C15H19ClO4 |
| InChI | InChI=1S/C15H19ClO4/c1-3-4-9-19-14(17)7-8-15(18)20-12-5-6-13(16)11(2)10-12/h5-6,10H,3-4,7-9H2,1-2H3 |
| InChIKey | ZSPZYDNCBMLVLY-UHFFFAOYSA-N |
| SMILES | CCCCOC(CCC(OC=1C=CC(=C(C)C1)Cl)=O)=O |