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6-CYCLOHEXYL-1,2,4,5-TETRAKIS-(TRIFLUOROMETHYL)-6-AZA-3-THIATRICYCLO-[3.1.0.0.(2,4)]-HEXANE
SpectraBase Compound ID JRS3JVOMV7Z
InChI InChI=1S/C14H11F12NS/c15-11(16,17)7-8(12(18,19)20,27(7)6-4-2-1-3-5-6)10(14(24,25)26)9(7,28-10)13(21,22)23/h6H,1-5H2/t7-,8+,9+,10-,27?
InChIKey VZDJLVAORHIODZ-YXPCGCOSSA-N
Mol Weight 453.29 g/mol
Molecular Formula C14H11F12NS
Exact Mass 453.042058 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3OxaeBx7Fu3
Name 6-CYCLOHEXYL-1,2,4,5-TETRAKIS-(TRIFLUOROMETHYL)-6-AZA-3-THIATRICYCLO-[3.1.0.0.(2,4)]-HEXANE
CAS Registry Number 64724-57-8
Compound Number 3B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H11F12NS
InChI InChI=1S/C14H11F12NS/c15-11(16,17)7-8(12(18,19)20,27(7)6-4-2-1-3-5-6)10(14(24,25)26)9(7,28-10)13(21,22)23/h6H,1-5H2/t7-,8+,9+,10-,27?
InChIKey VZDJLVAORHIODZ-YXPCGCOSSA-N
Literature Reference Author Y.KOBAYASHI,A.ANDO,K.KAWADA,I.KUMADAKI
Literature Reference Citation J.ORG.CHEM.,45,2966(1980)
Literature Reference DOI 10.1021/jo01303a010
Solvent CDCl3
Source File Reference UWPS1636