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1(E),10(E)-BIS-(METHYLTHIO)-[2.2]-METACYCLOPHANE
SpectraBase Compound ID 4BmUDQXJhN4
InChI InChI=1S/C18H20S2/c1-19-17-10-13-5-3-6-14(9-13)11-18(20-2)16-8-4-7-15(17)12-16/h3-9,12,17-18H,10-11H2,1-2H3/t17-,18+
InChIKey GKYOODAAZGNSHZ-HDICACEKSA-N
Mol Weight 300.48 g/mol
Molecular Formula C18H20S2
Exact Mass 300.100643 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H1clj1NbNOv
Name 1(E),10(E)-BIS-(METHYLTHIO)-[2.2]-METACYCLOPHANE
Compound Number 10D-ANTI
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H20S2
InChI InChI=1S/C18H20S2/c1-19-17-10-13-5-3-6-14(9-13)11-18(20-2)16-8-4-7-15(17)12-16/h3-9,12,17-18H,10-11H2,1-2H3/t17-,18+
InChIKey GKYOODAAZGNSHZ-HDICACEKSA-N
Literature Reference Author R.H.MITCHELL,T.K.VINOD,G.W.BUSHNELL
Literature Reference Citation J.AM.CHEM.SOC.,112,3487(1990)
Literature Reference DOI 10.1021/ja00165a037
Molecular Weight 300.477 g/mol
Solvent Unknown
Source File Reference UWRU6642