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DISODIUM-3-(HYDROXYMETHYL)-BENZYLPHOSPHONATE

View entire compound with spectra: 2 NMR

DISODIUM-3-(HYDROXYMETHYL)-BENZYLPHOSPHONATE
SpectraBase Compound ID 8edTvd9S2G2
InChI InChI=1S/C8H11O4P.2Na/c9-5-7-2-1-3-8(4-7)6-13(10,11)12;;/h1-4,9H,5-6H2,(H2,10,11,12);;/q;2*+1/p-2
InChIKey CDMABZWIOUOHLE-UHFFFAOYSA-L
Mol Weight 246.10930056 g/mol
Molecular Formula C8H9Na2O4P
Exact Mass 246.003384 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID r17MrfYw0V
Name DISODIUM-3-(HYDROXYMETHYL)-BENZYLPHOSPHONATE
Compound Number 19
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H9Na2O4P
InChI InChI=1S/C8H11O4P.2Na/c9-5-7-2-1-3-8(4-7)6-13(10,11)12;;/h1-4,9H,5-6H2,(H2,10,11,12);;/q;2*+1/p-2
InChIKey CDMABZWIOUOHLE-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
Molecular Weight 246.110 g/mol
Solvent D2O
Source File Reference UWVN27202