| SpectraBase Compound ID | Cc94oYiw365 |
|---|---|
| InChI | InChI=1S/C8H14O3/c1-6(4-7(2)9)5-8(10)11-3/h6H,4-5H2,1-3H3 |
| InChIKey | QIZFMIXTHKTRJG-UHFFFAOYSA-N |
| Mol Weight | 158.2 g/mol |
| Molecular Formula | C8H14O3 |
| Exact Mass | 158.094294 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 11A05rAQPQw |
|---|---|
| Name | 3-Methyl-5-oxo-hexanoic acid, methyl ester |
| CAS Registry Number | 89393-67-9 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C8H14O3 |
| InChI | InChI=1S/C8H14O3/c1-6(4-7(2)9)5-8(10)11-3/h6H,4-5H2,1-3H3 |
| InChIKey | QIZFMIXTHKTRJG-UHFFFAOYSA-N |
| Literature Reference | L.S. Hegedus, W.H. Darlington, J. Am. Chem. Soc. 102, 4980 (1980). |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |