| SpectraBase Compound ID | 2KS5ycP5wm5 |
|---|---|
| InChI | InChI=1S/2C6H10O3.Ca/c2*1-3-4(2)5(7)6(8)9;/h2*4H,3H2,1-2H3,(H,8,9);/q;;+2/p-2 |
| InChIKey | PTFSVYLXDCGPFY-UHFFFAOYSA-L |
| Mol Weight | 298.3 g/mol |
| Molecular Formula | C12H18CaO6 |
| Exact Mass | 298.072929 g/mol |
13C Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | HYTgYQSM3W5 |
|---|---|
| Name | 3-METHYL-2-OXOVALERIC ACID, CALCIUM SALT |
| Source of Sample | Tokyo Kasei Kogyo Company, Ltd., Tokyo, Japan |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H18CaO6 |
| InChI | InChI=1S/2C6H10O3.Ca/c2*1-3-4(2)5(7)6(8)9;/h2*4H,3H2,1-2H3,(H,8,9);/q;;+2/p-2 |
| InChIKey | PTFSVYLXDCGPFY-UHFFFAOYSA-L |
| Molecular Weight | 298.35 |
| Solvent | Polysol; Reference=TMS Spectrometer= Varian CFT-20 |