| SpectraBase Compound ID | 456bRQgClP |
|---|---|
| InChI | InChI=1S/C6H12O2/c1-4-6(2,3)5(7)8/h4H2,1-3H3,(H,7,8) |
| InChIKey | VUAXHMVRKOTJKP-UHFFFAOYSA-N |
| Mol Weight | 116.16 g/mol |
| Molecular Formula | C6H12O2 |
| Exact Mass | 116.08373 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GfoSNcxTaOv |
|---|---|
| Name | Butanoic acid, 2,2-dimethyl- |
| CAS Registry Number | 595-37-9 |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C6H12O2 |
| InChI | InChI=1S/C6H12O2/c1-4-6(2,3)5(7)8/h4H2,1-3H3,(H,7,8) |
| InChIKey | VUAXHMVRKOTJKP-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Literature Reference | P.A. Couperus, A.D. Clague, Org. Magn. Resonance 11, 590 (1978). |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |