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6B-NITROHEXAHYDRO-2H-1,3,5-TRIOXACYCLOPENTA-[CD]-PENTALENE-2,4,6-TRIOL
SpectraBase Compound ID 7IQdCTc1o5C
InChI InChI=1S/C7H9NO8/c9-4-1-7(8(12)13)2(5(10)14-1)16-6(11)3(7)15-4/h1-6,9-11H/t1?,2?,3?,4-,5-,6-,7+/m0/s1
InChIKey FGOOOSMPKZXLEM-DUPHCLQASA-N
Mol Weight 235.15 g/mol
Molecular Formula C7H9NO8
Exact Mass 235.032816 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AUYVWJohkg8
Name 6B-NITROHEXAHYDRO-2H-1,3,5-TRIOXACYCLOPENTA-[CD]-PENTALENE-2,4,6-TRIOL
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H9NO8
InChI InChI=1S/C7H9NO8/c9-4-1-7(8(12)13)2(5(10)14-1)16-6(11)3(7)15-4/h1-6,9-11H/t1?,2?,3?,4-,5-,6-,7+/m0/s1
InChIKey FGOOOSMPKZXLEM-DUPHCLQASA-N
Literature Reference Author S.CUDZILO,M.NITA,A.CHOLUJ,M.SZALA,W.DANIKIEWICZ,G.SPOLNIK,S. KROMPIEC,S.MICHALIK,
Literature Reference Citation PROP.EXPL.PYROT.,37,261(2012)
Literature Reference DOI 10.1002/prep.201000133
Molecular Weight 235.150 g/mol
Solvent DMSO-D6
Source File Reference UWLU78342