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(1-PROPIONYLOXY-4-PROPIONYLAMINOBUTYLIDENE)-1,1-BISPHOSPHONIC-ACID-DISODIUM-SALT

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(1-PROPIONYLOXY-4-PROPIONYLAMINOBUTYLIDENE)-1,1-BISPHOSPHONIC-ACID-DISODIUM-SALT
SpectraBase Compound ID KOCiX0R6WAQ
InChI InChI=1S/C10H21NO9P2.2Na/c1-3-8(12)11-7-5-6-10(21(14,15)16,22(17,18)19)20-9(13)4-2;;/h3-7H2,1-2H3,(H,11,12)(H2,14,15,16)(H2,17,18,19);;/q;2*+1/p-2
InChIKey RATLLOHHIFYFBY-UHFFFAOYSA-L
Mol Weight 405.18706256 g/mol
Molecular Formula C10H19NNa2O9P2
Exact Mass 405.033044 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7Ap5hPQA811
Name (1-PROPIONYLOXY-4-PROPIONYLAMINOBUTYLIDENE)-1,1-BISPHOSPHONIC-ACID-DISODIUM-SALT
Compound Number 1B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H17NNa2O9P2
InChI InChI=1S/C10H21NO9P2.2Na/c1-3-8(12)11-7-5-6-10(21(14,15)16,22(17,18)19)20-9(13)4-2;;/h3-7H2,1-2H3,(H,11,12)(H2,14,15,16)(H2,17,18,19);;/q;2*+1/p-2
InChIKey RATLLOHHIFYFBY-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 UWBT10988