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(1-ACETYLOXY-4-ACETYLAMINOBUTYLIDENE)-1,1-BISPHOSPHONIC-ACID-DISODIUM-SALT

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(1-ACETYLOXY-4-ACETYLAMINOBUTYLIDENE)-1,1-BISPHOSPHONIC-ACID-DISODIUM-SALT
SpectraBase Compound ID 7dB3BiZjMZR
InChI InChI=1S/C8H17NO9P2.2Na/c1-6(10)9-5-3-4-8(18-7(2)11,19(12,13)14)20(15,16)17;;/h3-5H2,1-2H3,(H,9,10)(H2,12,13,14)(H2,15,16,17);;/q;2*+1/p-2
InChIKey NWAIFQDZFIJZNA-UHFFFAOYSA-L
Mol Weight 377.13306256 g/mol
Molecular Formula C8H15NNa2O9P2
Exact Mass 377.001744 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5IIeCOh9SOi
Name (1-ACETYLOXY-4-ACETYLAMINOBUTYLIDENE)-1,1-BISPHOSPHONIC-ACID-DISODIUM-SALT
Compound Number 1A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H13NNa2O9P2
InChI InChI=1S/C8H17NO9P2.2Na/c1-6(10)9-5-3-4-8(18-7(2)11,19(12,13)14)20(15,16)17;;/h3-5H2,1-2H3,(H,9,10)(H2,12,13,14)(H2,15,16,17);;/q;2*+1/p-2
InChIKey NWAIFQDZFIJZNA-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 UWBT10987