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(1-BENZYLIMIDAZOL-2-YL)-AMINOMETHYLENEBISPHOSPHONIC-ACID

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(1-BENZYLIMIDAZOL-2-YL)-AMINOMETHYLENEBISPHOSPHONIC-ACID
SpectraBase Compound ID 6bNPXA22RnV
InChI InChI=1S/C11H15N3O6P2/c15-21(16,17)11(22(18,19)20)13-10-12-6-7-14(10)8-9-4-2-1-3-5-9/h1-7,11H,8H2,(H,12,13)(H2,15,16,17)(H2,18,19,20)
InChIKey YMQWRNLJENPKRM-UHFFFAOYSA-N
Mol Weight 347.2 g/mol
Molecular Formula C11H15N3O6P2
Exact Mass 347.043609 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J28mYLxCBC0
Name (1-BENZYLIMIDAZOL-2-YL)-AMINOMETHYLENEBISPHOSPHONIC-ACID
Compound Number 8L
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H11N3O6P2
InChI InChI=1S/C11H15N3O6P2/c15-21(16,17)11(22(18,19)20)13-10-12-6-7-14(10)8-9-4-2-1-3-5-9/h1-7,11H,8H2,(H,12,13)(H2,15,16,17)(H2,18,19,20)
InChIKey YMQWRNLJENPKRM-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 UWLU53080