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4-AMINO-1-HYDROXYBUTANE-1,1-BIPHOSPHONIC-ACID-MONOSODIUM-SALT
SpectraBase Compound ID 5q9xfjRTN8N
InChI InChI=1S/C4H12NO7P2.Na/c5-3-1-2-4(6,13(7,8)9)14(10,11)12;/h1-3,5H2,(H2,7,8,9)(H2,10,11,12);/q-1;+1
InChIKey JOWOZLHLHOIRTL-UHFFFAOYSA-N
Mol Weight 271.08 g/mol
Molecular Formula C4H12NNaO7P2
Exact Mass 270.99867 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9DrPsUYZALi
Name 4-AMINO-1-HYDROXYBUTANE-1,1-BIPHOSPHONIC-ACID-MONOSODIUM-SALT
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C4H8NNaO7P2
InChI InChI=1S/C4H12NO7P2.Na/c5-3-1-2-4(6,13(7,8)9)14(10,11)12;/h1-3,5H2,(H2,7,8,9)(H2,10,11,12);/q-1;+1
InChIKey JOWOZLHLHOIRTL-UHFFFAOYSA-N
Literature Reference Author M.B.MARTIN,J.S.GRIMLEY,J.C.LEWIS,H.T.HEATH,B.N.BAILEY,H.KEND RICK,V.YARDLEY,A.CAL
Literature Reference Citation J.MED.CHEM.,44,909(2001)
Literature Reference DOI 10.1021/jm0002578
Molecular Weight 267.047 g/mol
Sample ID 44356
Solvent NAOD