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3,3-Dimethyl-2,4-pentanedione
SpectraBase Compound ID 4KSfCk2wwcK
InChI InChI=1S/C7H12O2/c1-5(8)7(3,4)6(2)9/h1-4H3
InChIKey SWGDHTSWHSSMLE-UHFFFAOYSA-N
Mol Weight 128.17 g/mol
Molecular Formula C7H12O2
Exact Mass 128.08373 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID If0PcDTdQkr
Name 3,3-Dimethyl-2,4-pentanedione
CAS Registry Number 3142-58-3
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C7H12O2
InChI InChI=1S/C7H12O2/c1-5(8)7(3,4)6(2)9/h1-4H3
InChIKey SWGDHTSWHSSMLE-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference G.A. Olah, J.L. Grant, P.W. Westerman, J. Org. Chem. 40, 2102 (1975).
NMR Standard TMS Ext.
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent SO2 liquid