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

View entire compound with spectra: 2 NMR

(1-PHENYLIMIDAZOL-2-YL)-AMINOMETHYLENEBISPHOSPHONIC-ACID
SpectraBase Compound ID KB9wIpYzz9G
InChI InChI=1S/C10H13N3O6P2/c14-20(15,16)10(21(17,18)19)12-9-11-6-7-13(9)8-4-2-1-3-5-8/h1-7,10H,(H,11,12)(H2,14,15,16)(H2,17,18,19)
InChIKey GQZPWXFCNKYYNO-UHFFFAOYSA-N
Mol Weight 333.18 g/mol
Molecular Formula C10H13N3O6P2
Exact Mass 333.027959 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2AEYo1woiUQ
Name (1-PHENYLIMIDAZOL-2-YL)-AMINOMETHYLENEBISPHOSPHONIC-ACID
Compound Number 8M
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H9N3O6P2
InChI InChI=1S/C10H13N3O6P2/c14-20(15,16)10(21(17,18)19)12-9-11-6-7-13(9)8-4-2-1-3-5-8/h1-7,10H,(H,11,12)(H2,14,15,16)(H2,17,18,19)
InChIKey GQZPWXFCNKYYNO-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
Molecular Weight 329.145 g/mol
Sample ID 53081
Solvent NAOD:D2O=1:20