John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=INqItoc19k8 SpectraBase Spectrum ID=2ARQDEttVsV

(accessed ).
1,2,4,5-TETRAKIS-(TRIFLUOROMETHYL)-6-AZA-3-THIATRICYCLO-[3.1.0.0.(2,4)]-HEXANE
SpectraBase Compound ID INqItoc19k8
InChI InChI=1S/C8HF12NS/c9-5(10,11)1-2(21-1,6(12,13)14)4(8(18,19)20)3(1,22-4)7(15,16)17/h21H/t1-,2+,3+,4-
InChIKey QUBBQEWQEBLOIG-DUHBMQHGSA-N
Mol Weight 371.14 g/mol
Molecular Formula C8HF12NS
Exact Mass 370.96381 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2ARQDEttVsV
Name 1,2,4,5-TETRAKIS-(TRIFLUOROMETHYL)-6-AZA-3-THIATRICYCLO-[3.1.0.0.(2,4)]-HEXANE
CAS Registry Number 73688-04-7
Compound Number 3D
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8HF12NS
InChI InChI=1S/C8HF12NS/c9-5(10,11)1-2(21-1,6(12,13)14)4(8(18,19)20)3(1,22-4)7(15,16)17/h21H/t1-,2+,3+,4-
InChIKey QUBBQEWQEBLOIG-DUHBMQHGSA-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 UWPS1638
SpectraBase Batch ID HRL2m85eVGU