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2,2-Dimethyl-1-phenyl-pentane-1,4-dione
SpectraBase Compound ID DMFi78RRrMW
InChI InChI=1S/C13H16O2/c1-10(14)9-13(2,3)12(15)11-7-5-4-6-8-11/h4-8H,9H2,1-3H3
InChIKey CFFGMLOTCQHNLB-UHFFFAOYSA-N
Mol Weight 204.27 g/mol
Molecular Formula C13H16O2
Exact Mass 204.11503 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4J5OGEyGfiO
Name 2,2-Dimethyl-1-phenyl-pentane-1,4-dione
CAS Registry Number 39121-67-0
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H16O2
InChI InChI=1S/C13H16O2/c1-10(14)9-13(2,3)12(15)11-7-5-4-6-8-11/h4-8H,9H2,1-3H3
InChIKey CFFGMLOTCQHNLB-UHFFFAOYSA-N
Instrument Name Jeol FX-90
Literature Reference K-H. Lui, M.P. Sammes, J. Chem. Soc. Perkin I 457 (1990).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3