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DISODIUM-3-METHYLBENZYLPHOSPHONATE

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DISODIUM-3-METHYLBENZYLPHOSPHONATE
SpectraBase Compound ID BZWxKMqk0BV
InChI InChI=1S/C8H11O3P.2Na/c1-7-3-2-4-8(5-7)6-12(9,10)11;;/h2-5H,6H2,1H3,(H2,9,10,11);;/q;2*+1/p-2
InChIKey FASHWABSMBDXTC-UHFFFAOYSA-L
Mol Weight 230.11030056 g/mol
Molecular Formula C8H9Na2O3P
Exact Mass 230.00847 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KOXUVePqHZo
Name DISODIUM-3-METHYLBENZYLPHOSPHONATE
Compound Number 20
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H9Na2O3P
InChI InChI=1S/C8H11O3P.2Na/c1-7-3-2-4-8(5-7)6-12(9,10)11;;/h2-5H,6H2,1H3,(H2,9,10,11);;/q;2*+1/p-2
InChIKey FASHWABSMBDXTC-UHFFFAOYSA-L
Literature Reference Author A.K.BHATTACHARYA,F.STOLZ,J.KURZECK,W.RUEGER,R.R.SCHMIDT
Literature Reference Citation CAN.J.CHEM.,80,973(2002)
Literature Reference DOI 10.1139/v02-119
Solvent D2O
Source File Reference UWVN27209