SpectraBase Compound ID | KrlmDP4gYvI |
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InChI | InChI=1S/C6H12O/c1-5(7)6(2,3)4/h1-4H3 |
InChIKey | PJGSXYOJTGTZAV-UHFFFAOYSA-N |
Mol Weight | 100.16 g/mol |
Molecular Formula | C6H12O |
Exact Mass | 100.088815 g/mol |
SpectraBase Spectrum ID | GxlQ0DOG6YH |
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Name | 3,3-Dimethyl-butanone-2 |
CAS Registry Number | 75-97-8 |
Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C6H12O |
InChI | InChI=1S/C6H12O/c1-5(7)6(2,3)4/h1-4H3 |
InChIKey | PJGSXYOJTGTZAV-UHFFFAOYSA-N |
Instrument Name | Bruker WM-250 |
Literature Reference | P.L. Robinson, C.N. Barry, J.W.Kelly, J. Am. Chem. Soc. 107, 5211 (1985). |
NMR Standard | TMS |
Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
Solvent | CDCl3 |