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2,2-Dimethyl-3-pentanone
SpectraBase Compound ID HnKWuziDKK5
InChI InChI=1S/C7H14O/c1-5-6(8)7(2,3)4/h5H2,1-4H3
InChIKey VLNUTKMHYLQCQB-UHFFFAOYSA-N
Mol Weight 114.19 g/mol
Molecular Formula C7H14O
Exact Mass 114.104465 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JXcjGQodn1X
Name 2,2-Dimethyl-pentanone-3
CAS Registry Number 564-04-5
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C7H14O
InChI InChI=1S/C7H14O/c1-5-6(8)7(2,3)4/h5H2,1-4H3
InChIKey VLNUTKMHYLQCQB-UHFFFAOYSA-N
Instrument Name Special
Literature Reference G.E. Hawkes, K. Herwig, J.D. Roberts, J. Org. Chem. 39, 1017 (1974).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3