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3-TRIFLUOROMETHYL-2-THIABICYCLO-[2.2.2]-OCT-5-ENE
SpectraBase Compound ID 2j3a1WC2YzV
InChI InChI=1S/C8H9F3S/c9-8(10,11)7-5-1-3-6(12-7)4-2-5/h1,3,5-7H,2,4H2/t5-,6+,7+/m0/s1
InChIKey YJMLUKPNWLVXFH-RRKCRQDMSA-N
Mol Weight 194.22 g/mol
Molecular Formula C8H9F3S
Exact Mass 194.037706 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1pEQOtSDl5K
Name 3-TRIFLUOROMETHYL-2-THIABICYCLO-[2.2.2]-OCT-5-ENE
CAS Registry Number 122491-45-6
Compound Number 15C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H9F3S
InChI InChI=1S/C8H9F3S/c9-8(10,11)7-5-1-3-6(12-7)4-2-5/h1,3,5-7H,2,4H2/t5-,6+,7+/m0/s1
InChIKey YJMLUKPNWLVXFH-RRKCRQDMSA-N
Literature Reference Author B.SCHULER,W.SUNDERMEYER
Literature Reference Citation CHEM.BER.,123,177(1990)
Literature Reference DOI 10.1002/cber.19901230130
Molecular Weight 194.215 g/mol
Solvent CDCl3
Source File Reference UWED12269