| SpectraBase Compound ID | Dgf4bVoPGsh |
|---|---|
| InChI | InChI=1S/C6H12O2/c1-6(2,3)4-5(7)8/h4H2,1-3H3,(H,7,8) |
| InChIKey | MLMQPDHYNJCQAO-UHFFFAOYSA-N |
| Mol Weight | 116.16 g/mol |
| Molecular Formula | C6H12O2 |
| Exact Mass | 116.08373 g/mol |
17O Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2IDZWqzy4Cm |
|---|---|
| Name | 3,3-Dimethyl-butanoic acid |
| CAS Registry Number | 1070-83-3 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C6H12O2 |
| InChI | InChI=1S/C6H12O2/c1-6(2,3)4-5(7)8/h4H2,1-3H3,(H,7,8) |
| InChIKey | MLMQPDHYNJCQAO-UHFFFAOYSA-N |
| Instrument Name | SF = 060 MHz |
| Literature Reference | Helv. Chim. Acta 63, 498 (1980). |
| NMR Standard | not reported |
| Observed nucleus | 17O |
| Solvent | Neat liquid |