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3,8-PHOSPHONANEDIONE-1-OXIDE-#23,ISOMER-#1
SpectraBase Compound ID AuPEfdjGPVj
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/t12-,13+,20?
InChIKey XDHXDXIRYFZYRO-QNBIARANSA-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 Hds0e9n63fj
Name 3,8-PHOSPHONANEDIONE-1-OXIDE-#23,ISOMER-#2
CAS Registry Number 80794-94-1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. 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/t12-,13+,20?
InChIKey XDHXDXIRYFZYRO-QNBIARANSA-N
Literature Reference Author L.D.QUIN,E.D.MIDDLEMAS,N.S.RAO,R.W.MILLER,A.T.MCPHAIL
Literature Reference Citation J.AM.CHEM.SOC.,104,1893(1982)
Literature Reference DOI 10.1021/ja00371a018
Molecular Weight 292.315 g/mol
Solvent CDCl3
Source File Reference UWCS2421