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3,3-SPIROCYCLOHEXANE-7-NITRO-2,1,4-BENZOXADIAZINE-4-OXIDE
SpectraBase Compound ID BhwDIa2mswF
InChI InChI=1S/C12H13N3O4/c16-14-11-5-4-9(15(17)18)8-10(11)13-19-12(14)6-2-1-3-7-12/h4-5,8H,1-3,6-7H2
InChIKey LXPWFDLSQYBWNL-UHFFFAOYSA-N
Mol Weight 263.25 g/mol
Molecular Formula C12H13N3O4
Exact Mass 263.090606 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6REXK4w2A7K
Name 3,3-SPIROCYCLOHEXANE-7-NITRO-2,1,4-BENZOXADIAZINE-4-OXIDE
Compound Number V-B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H13N3O4
InChI InChI=1S/C12H13N3O4/c16-14-11-5-4-9(15(17)18)8-10(11)13-19-12(14)6-2-1-3-7-12/h4-5,8H,1-3,6-7H2
InChIKey LXPWFDLSQYBWNL-UHFFFAOYSA-N
Literature Reference Author V.A.SAMSONOV,L.B.VOLODARSKII,O.V.SHAMIRZAEVA
Literature Reference Citation CHEM.HET.COMP.,30,460(1994)
Literature Reference DOI 10.1007/bf01169943
Molecular Weight 263.253 g/mol
Solvent CDCl3
Source File Reference UWMZ12838