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(1-HYDROXY-4-PIVALOYLAMINOBUTYLIDENE)-1,1-BISPHOSPHONIC-ACID-DISODIUM-SALT
SpectraBase Compound ID JVyKeS8PdA6
InChI InChI=1S/C9H21NO8P2.2Na/c1-8(2,3)7(11)10-6-4-5-9(12,19(13,14)15)20(16,17)18;;/h12H,4-6H2,1-3H3,(H,10,11)(H2,13,14,15)(H2,16,17,18);;/q;2*+1/p-2
InChIKey XMXAWPNIVAESMD-UHFFFAOYSA-L
Mol Weight 377.17706256 g/mol
Molecular Formula C9H19NNa2O8P2
Exact Mass 377.038129 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7dChYKlKN3c
Name (1-HYDROXY-4-PIVALOYLAMINOBUTYLIDENE)-1,1-BISPHOSPHONIC-ACID-DISODIUM-SALT
Compound Number 2D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H17NNa2O8P2
InChI InChI=1S/C9H21NO8P2.2Na/c1-8(2,3)7(11)10-6-4-5-9(12,19(13,14)15)20(16,17)18;;/h12H,4-6H2,1-3H3,(H,10,11)(H2,13,14,15)(H2,16,17,18);;/q;2*+1/p-2
InChIKey XMXAWPNIVAESMD-UHFFFAOYSA-L
Literature Reference Author P.A.TURHANEN,J.J.VEPSAELAEINEN
Literature Reference Citation BEIL.J.ORG.CHEM.,2,2,1(2006)
Literature Reference DOI 10.1186/1860-5397-2-2
Solvent D2O
Source File Reference UWBT10994