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T-5-ACETOXY-6-METHYL-3-(METHYLETHYL)-1,R-3,T-4,C-6-TETRANITRO-CYCLOHEXENE
SpectraBase Compound ID BpVADqnliUP
InChI InChI=1S/C12H17N3O9/c1-6(2)12(17)5-8(13(18)19)11(4,15(22)23)10(24-7(3)16)9(12)14(20)21/h5-6,9-10,17H,1-4H3
InChIKey NCKFBQWCTVGMEU-UHFFFAOYSA-N
Mol Weight 347.28 g/mol
Molecular Formula C12H17N3O9
Exact Mass 347.096479 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FGaFGKk5k4j
Name T-5-ACETOXY-6-METHYL-3-(METHYLETHYL)-1,R-3,T-4,C-6-TETRANITRO-CYCLOHEXENE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H17N3O9
InChI InChI=1S/C12H17N3O9/c1-6(2)12(17)5-8(13(18)19)11(4,15(22)23)10(24-7(3)16)9(12)14(20)21/h5-6,9-10,17H,1-4H3
InChIKey NCKFBQWCTVGMEU-UHFFFAOYSA-N
Literature Reference Author M.P.HARTSHORN,W.T.ROBINSON,A.G.WALLER,G.J.WRIGHT
Literature Reference Citation AUSTR.J.CHEM.,42,2143(1989)
Literature Reference DOI 10.1071/ch9892143
Molecular Weight 347.282 g/mol
Solvent CDCl3
Source File Reference UWWR1409