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1,2,2-TRINITROADAMANTANE
SpectraBase Compound ID 9suncwCsmhh
InChI InChI=1S/C10H13N3O6/c14-11(15)9-4-6-1-7(5-9)3-8(2-6)10(9,12(16)17)13(18)19/h6-8H,1-5H2/t6-,7+,8-,9-
InChIKey YDQNFSZMZFJTPB-WKALFLHCSA-N
Mol Weight 271.23 g/mol
Molecular Formula C10H13N3O6
Exact Mass 271.080435 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 40rhV4LEU5J
Name 1,2,2-TRINITROADAMANTANE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H13N3O6
InChI InChI=1S/C10H13N3O6/c14-11(15)9-4-6-1-7(5-9)3-8(2-6)10(9,12(16)17)13(18)19/h6-8H,1-5H2/t6-,7+,8-,9-
InChIKey YDQNFSZMZFJTPB-WKALFLHCSA-N
Literature Reference Author P.R.DAVE,T.AXENROD,L.QI,A.BRACUTI
Literature Reference Citation J.ORG.CHEM.,60,1895(1995)
Literature Reference DOI 10.1021/jo00111a062
Molecular Weight 271.230 g/mol
Solvent CDCl3
Source File Reference UWGE741