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2,5-Dihydro-2,2,5,5-tetrakis(trifluoromethyl)-4-thiazolylthiocyanate
SpectraBase Compound ID IfnIIxnevW1
InChI InChI=1S/C8F12N2S2/c9-5(10,11)3(6(12,13)14)2(23-1-21)22-4(24-3,7(15,16)17)8(18,19)20
InChIKey AXSFQUURDAIFPG-UHFFFAOYSA-N
Mol Weight 416.2 g/mol
Molecular Formula C8F12N2S2
Exact Mass 415.931128 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5LSs5YGcWto
Name 2,5-DIHYDRO-2,2,5,5-TETRAKIS-(TRIFLUOROMETHYL)-4-THIAZOLYLTHIOCYANATE
CAS Registry Number 124177-42-0
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8F12N2S2
InChI InChI=1S/C8F12N2S2/c9-5(10,11)3(6(12,13)14)2(23-1-21)22-4(24-3,7(15,16)17)8(18,19)20
InChIKey AXSFQUURDAIFPG-UHFFFAOYSA-N
Literature Reference Author J.SUNDERMEYER,H.W.ROESKY,J.LAUTNER,P.G.JONES
Literature Reference Citation CHEM.BER.,123,433(1990)
Literature Reference DOI 10.1002/cber.19901230304
Molecular Weight 416.202 g/mol
Solvent CDCl3
Source File Reference UWCS13564