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10,13-BIS-(PHENYLSULFONYL)-TETRACYCLO-[6.3.3.0(1,8).0(9,14)]-TETRADECA-10,12-DIENE
SpectraBase Compound ID wsPxnqRAxl
InChI InChI=1S/C26H26O4S2/c27-31(28,19-11-5-3-6-12-19)21-17-25-15-9-1-2-10-16-26(25)23(21)24(26)22(18-25)32(29,30)20-13-7-4-8-14-20/h3-8,11-14,17-18,23-24H,1-2,9-10,15-16H2/t23-,24+,25+,26-
InChIKey PBNVGAHTGXNRNA-FATVKVNYSA-N
Mol Weight 466.61 g/mol
Molecular Formula C26H26O4S2
Exact Mass 466.127252 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G1KdWyywrze
Name 10,13-BIS-(PHENYLSULFONYL)-TETRACYCLO-[6.3.3.0(1,8).0(9,14)]-TETRADECA-10,12-DIENE
CAS Registry Number 139493-34-8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H26O4S2
InChI InChI=1S/C26H26O4S2/c27-31(28,19-11-5-3-6-12-19)21-17-25-15-9-1-2-10-16-26(25)23(21)24(26)22(18-25)32(29,30)20-13-7-4-8-14-20/h3-8,11-14,17-18,23-24H,1-2,9-10,15-16H2/t23-,24+,25+,26-
InChIKey PBNVGAHTGXNRNA-FATVKVNYSA-N
Literature Reference Author H.QUAST,J.CARLSEN,R.JANIAK,E.M.PETERS,K.PETERS,H.G.VONSCHNER ING
Literature Reference Citation CHEM.BER.,125,955(1992)
Literature Reference DOI 10.1002/cber.19921250430
Molecular Weight 466.610 g/mol
Solvent CDCl3
Source File Reference UWCS8675