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(4-AMINO-1-HYDROXYBUTYLIDENE)-BIS-PHOSPHONIC-ACID

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(4-AMINO-1-HYDROXYBUTYLIDENE)-BIS-PHOSPHONIC-ACID
SpectraBase Compound ID 1WTf0xyHV3e
InChI InChI=1S/C4H13NO7P2/c5-3-1-2-4(6,13(7,8)9)14(10,11)12/h6H,1-3,5H2,(H2,7,8,9)(H2,10,11,12)
InChIKey OGSPWJRAVKPPFI-UHFFFAOYSA-N
Mol Weight 249.1 g/mol
Molecular Formula C4H13NO7P2
Exact Mass 249.016726 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID tf70dxHWnU
Name 1-HYDROXY-4-AMINOBUTYLIDENE-1,1-BISPHOSPHONIC-ACID;ALENDRONATE
Compound Number 1C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C4H9NO7P2
InChI InChI=1S/C4H13NO7P2/c5-3-1-2-4(6,13(7,8)9)14(10,11)12/h6H,1-3,5H2,(H2,7,8,9)(H2,10,11,12)
InChIKey OGSPWJRAVKPPFI-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 UWLU53001