| SpectraBase Compound ID | Fet0jvkTwPp |
|---|---|
| InChI | InChI=1S/C16H21ClO5/c1-2-3-10-21-15(18)8-9-16(19)22-12-11-20-14-7-5-4-6-13(14)17/h4-7H,2-3,8-12H2,1H3 |
| InChIKey | HRAXHLDFUFFIGK-UHFFFAOYSA-N |
| Mol Weight | 328.79 g/mol |
| Molecular Formula | C16H21ClO5 |
| Exact Mass | 328.107751 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2Kyo4hC4JsS |
|---|---|
| Name | Succinic acid, butyl 2-(2-chlorophenoxy)ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 328.107751471 u |
| Formula | C16H21ClO5 |
| InChI | InChI=1S/C16H21ClO5/c1-2-3-10-21-15(18)8-9-16(19)22-12-11-20-14-7-5-4-6-13(14)17/h4-7H,2-3,8-12H2,1H3 |
| InChIKey | HRAXHLDFUFFIGK-UHFFFAOYSA-N |
| Molecular Weight | 328.792 g/mol |
| SMILES | C(CCC(OCCOC1=CC=CC=C1Cl)=O)(OCCCC)=O |