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1,8-DIHYDROXYOCTANE-1,8-BISPHOSPHONIC-ACID

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1,8-DIHYDROXYOCTANE-1,8-BISPHOSPHONIC-ACID
SpectraBase Compound ID 7vsNku16NG4
InChI InChI=1S/C8H20O8P2/c9-7(17(11,12)13)5-3-1-2-4-6-8(10)18(14,15)16/h7-10H,1-6H2,(H2,11,12,13)(H2,14,15,16)
InChIKey DALKMSCKTLUMPV-UHFFFAOYSA-N
Mol Weight 306.19 g/mol
Molecular Formula C8H20O8P2
Exact Mass 306.063342 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Fs7awNcCKaW
Name 1,8-DIHYDROXYOCTANE-1,8-BISPHOSPHONIC-ACID
Compound Number 3C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H16O8P2
InChI InChI=1S/C8H20O8P2/c9-7(17(11,12)13)5-3-1-2-4-6-8(10)18(14,15)16/h7-10H,1-6H2,(H2,11,12,13)(H2,14,15,16)
InChIKey DALKMSCKTLUMPV-UHFFFAOYSA-N
Literature Reference Author R.CHEN,E.BREUER
Literature Reference Citation J.ORG.CHEM.,63,5107(1998)
Literature Reference DOI 10.1021/jo9803129
Molecular Weight 302.158 g/mol
Sample ID 28660
Solvent Unknown