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9,9-DINITRO-8-(2-NITRO-1-PHENYLCYCLOHEXYLOXY)-7-OXA-8-AZASPIRO-[2.2.4.0]-DECANE;DIASTEREOMER_A;MAXIMUM_DIASTEREOMER
SpectraBase Compound ID 6r7Idrv7soi
InChI InChI=1S/C20H24N4O8/c25-21(26)16-8-4-5-9-19(16,15-6-2-1-3-7-15)32-24-20(22(27)28,23(29)30)14-18(31-24)13-12-17(18)10-11-17/h1-3,6-7,16H,4-5,8-14H2
InChIKey IFRNLZRSRJJGON-UHFFFAOYSA-N
Mol Weight 448.43 g/mol
Molecular Formula C20H24N4O8
Exact Mass 448.159414 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C3VdClFuf7Y
Name 9,9-DINITRO-8-(2-NITRO-1-PHENYLCYCLOHEXYLOXY)-7-OXA-8-AZASPIRO-[2.2.4.0]-DECANE;DIASTEREOMER_C;MINOR_DIASTEREOMER
Compound Number XIII-B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H24N4O8
InChI InChI=1S/C20H24N4O8/c25-21(26)16-8-4-5-9-19(16,15-6-2-1-3-7-15)32-24-20(22(27)28,23(29)30)14-18(31-24)13-12-17(18)10-11-17/h1-3,6-7,16H,4-5,8-14H2
InChIKey IFRNLZRSRJJGON-UHFFFAOYSA-N
Literature Reference Author E.B.AVERINA,E.M.BUDYNINA,O.A.IVANOVA,Y.K.GRISHIN,S.M.GERDOV, T.S.KUZNETSOVA,N.S.Z
Literature Reference Citation RUSS.J.ORG.CHEM.,40,162(2004)
Literature Reference DOI 10.1023/B:RUJO.0000034936.03355.d1
Molecular Weight 448.433 g/mol
Solvent CDCl3
Source File Reference UWMZ16874