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cis-5,6-Dimethyl-trans-1-phenyl-1,3,8-trioxo-phosphanone
SpectraBase Compound ID yQ5PN2aOgd
InChI InChI=1S/C16H21O3P/c1-12-8-14(17)10-20(19,11-15(18)9-13(12)2)16-6-4-3-5-7-16/h3-7,12-13H,8-11H2,1-2H3
InChIKey XDHXDXIRYFZYRO-UHFFFAOYSA-N
Mol Weight 292.31 g/mol
Molecular Formula C16H21O3P
Exact Mass 292.122832 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GURc9mPWzmv
Name cis-5,6-Dimethyl-trans-1-phenyl-1,3,8-trioxo-phosphanone
CAS Registry Number 80754-61-6
Comments MAJOR ISOMER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C16H21O3P
InChI InChI=1S/C16H21O3P/c1-12-8-14(17)10-20(19,11-15(18)9-13(12)2)16-6-4-3-5-7-16/h3-7,12-13H,8-11H2,1-2H3
InChIKey XDHXDXIRYFZYRO-UHFFFAOYSA-N
Instrument Name Jeol FX-90
Literature Reference L.D. Quin, E.D. Middlemas, N.S.Rao, J. Am. Chem. Soc. 104, 1893 (1982).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3