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1,5-DIMETHYL-2,6-BIS-(PHENYLSULFONYL)-TRICYCLO-[3.3.0.0(2,8)]-OCTA-2,6-DIENE
SpectraBase Compound ID 3eJWAoliLpF
InChI InChI=1S/C22H20O4S2/c1-20-13-14-22(28(25,26)17-11-7-4-8-12-17)18(21(20,22)2)15-19(20)27(23,24)16-9-5-3-6-10-16/h3-15,18H,1-2H3/t18-,20+,21-,22+/m1/s1
InChIKey SZCGKNNDOQLMEB-ZDFPQIBNSA-N
Mol Weight 412.52 g/mol
Molecular Formula C22H20O4S2
Exact Mass 412.080301 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LgZjY0zKG1v
Name 1,5-DIMETHYL-2,6-BIS-(PHENYLSULFONYL)-TRICYCLO-[3.3.0.0(2,8)]-OCTA-2,6-DIENE
CAS Registry Number 139462-64-9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H20O4S2
InChI InChI=1S/C22H20O4S2/c1-20-13-14-22(28(25,26)17-11-7-4-8-12-17)18(21(20,22)2)15-19(20)27(23,24)16-9-5-3-6-10-16/h3-15,18H,1-2H3/t18-,20+,21-,22+/m1/s1
InChIKey SZCGKNNDOQLMEB-ZDFPQIBNSA-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 412.518 g/mol
Solvent CDCl3
Source File Reference UWCS8654