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2-(THIAZOL-2-YL)-ETHYLIDENE-1,1-BISPHOSPHONIC-ACID
SpectraBase Compound ID IVSI84OH4UH
InChI InChI=1S/C5H9NO6P2S/c7-13(8,9)5(14(10,11)12)3-4-6-1-2-15-4/h1-2,5H,3H2,(H2,7,8,9)(H2,10,11,12)
InChIKey JGERUCQQMGBXSJ-UHFFFAOYSA-N
Mol Weight 273.14 g/mol
Molecular Formula C5H9NO6P2S
Exact Mass 272.962582 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5mQAdANQW6
Name 2-(THIAZOL-2-YL)-ETHYLIDENE-1,1-BISPHOSPHONIC-ACID
Compound Number 9A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C5H5NO6P2S
InChI InChI=1S/C5H9NO6P2S/c7-13(8,9)5(14(10,11)12)3-4-6-1-2-15-4/h1-2,5H,3H2,(H2,7,8,9)(H2,10,11,12)
InChIKey JGERUCQQMGBXSJ-UHFFFAOYSA-N
Literature Reference Author L.WIDLER,K.A.JAEGGI,M.GLATT,K.MUELLER,R.BACHMANN,M.BISPING,A .R.BORN,R.CORTESI,G.
Literature Reference Citation J.MED.CHEM.,45,3721(2002)
Literature Reference DOI 10.1021/jm020819i
Solvent NAOD:D2O=1:20
Source File Reference UWLU53068