| SpectraBase Compound ID | BBSOap3PbGT |
|---|---|
| InChI | InChI=1S/C7H12Cl2O2/c1-3-5(8)6(9)4-7(10)11-2/h5-6H,3-4H2,1-2H3 |
| InChIKey | SMOALSUWZPTUDL-UHFFFAOYSA-N |
| Mol Weight | 199.08 g/mol |
| Molecular Formula | C7H12Cl2O2 |
| Exact Mass | 198.021435 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AKdImIRbZVU |
|---|---|
| Name | 3,4-Dichloro-hexanoic acid, methyl ester |
| CAS Registry Number | 82498-87-1 |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C7H12Cl2O2 |
| InChI | InChI=1S/C7H12Cl2O2/c1-3-5(8)6(9)4-7(10)11-2/h5-6H,3-4H2,1-2H3 |
| InChIKey | SMOALSUWZPTUDL-UHFFFAOYSA-N |
| Instrument Name | Jeol FX-60 |
| Literature Reference | M. Pitkanen, Org. Magn. Resonance 18, 165 (1982). |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CCl4 |