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10,13-BIS-(PHENYLTHIO)-TRICYCLO-[6.3.3.0(1,8)]-TETRADECA-9,13-DIENE
SpectraBase Compound ID DjzcPN5XxCf
InChI InChI=1S/C26H28S2/c1-2-10-16-26-19-23(27-21-11-5-3-6-12-21)17-25(26,15-9-1)18-24(20-26)28-22-13-7-4-8-14-22/h3-8,11-14,17-18H,1-2,9-10,15-16,19-20H2/t25-,26+
InChIKey GSUXXEGVENFMFO-WMPKNSHKSA-N
Mol Weight 404.63 g/mol
Molecular Formula C26H28S2
Exact Mass 404.163243 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Cyf4jPc2mVI
Name 10,13-BIS-(PHENYLTHIO)-TRICYCLO-[6.3.3.0(1,8)]-TETRADECA-9,13-DIENE
CAS Registry Number 139462-76-3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H28S2
InChI InChI=1S/C26H28S2/c1-2-10-16-26-19-23(27-21-11-5-3-6-12-21)17-25(26,15-9-1)18-24(20-26)28-22-13-7-4-8-14-22/h3-8,11-14,17-18H,1-2,9-10,15-16,19-20H2/t25-,26+
InChIKey GSUXXEGVENFMFO-WMPKNSHKSA-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 404.628 g/mol
Solvent CDCl3
Source File Reference UWCS8665