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ALPHA-(PHENYLMETHYLENE)-DISPIRO-[CYCLOHEXANE-1,2'-BENZO-[1,2-D:4,5-D']-BIS-[1,3]-DIOXOLE-6',1''-CYCLOHEXANE]-4'-ACETONITRILE

View entire compound with spectra: 2 NMR

ALPHA-(PHENYLMETHYLENE)-DISPIRO-[CYCLOHEXANE-1,2'-BENZO-[1,2-D:4,5-D']-BIS-[1,3]-DIOXOLE-6',1''-CYCLOHEXANE]-4'-ACETONITRILE
SpectraBase Compound ID 3Lcf0TXnocw
InChI InChI=1S/C27H27NO4/c28-18-20(16-19-10-4-1-5-11-19)23-24-21(29-26(31-24)12-6-2-7-13-26)17-22-25(23)32-27(30-22)14-8-3-9-15-27/h1,4-5,10-11,16-17H,2-3,6-9,12-15H2/b20-16+
InChIKey DXZINISSXVAIAH-CAPFRKAQSA-N
Mol Weight 429.52 g/mol
Molecular Formula C27H27NO4
Exact Mass 429.194008 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4ijC7dwulPe
Name ALPHA-(PHENYLMETHYLENE)-DISPIRO-[CYCLOHEXANE-1,2'-BENZO-[1,2-D:4,5-D']-BIS-[1,3]-DIOXOLE-6',1''-CYCLOHEXANE]-4'-ACETONITRILE
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H27NO4
InChI InChI=1S/C27H27NO4/c28-18-20(16-19-10-4-1-5-11-19)23-24-21(29-26(31-24)12-6-2-7-13-26)17-22-25(23)32-27(30-22)14-8-3-9-15-27/h1,4-5,10-11,16-17H,2-3,6-9,12-15H2/b20-16+
InChIKey DXZINISSXVAIAH-CAPFRKAQSA-N
Literature Reference Author E.O.M.ORLEMANS,B.H.M.LAMMERINK,F.C.J.M.VANVEGGEL,W.VERBOOM,S .HARKEMA,D.N.REINHOU
Literature Reference Citation J.ORG.CHEM.,53,2278(1988)
Literature Reference DOI 10.1021/jo00245a028
Molecular Weight 429.516 g/mol
Solvent CDCl3
Source File Reference UNIW20942