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1-PHENYL-1-(O-BUTYLDITHIOCARBONATO)-2,2,2-TRIFLUOROETHYLISOCYANATE
SpectraBase Compound ID IEZBfeb1bDc
InChI InChI=1S/C14H14F3NO2S2/c1-2-3-9-20-12(21)22-13(18-10-19,14(15,16)17)11-7-5-4-6-8-11/h4-8H,2-3,9H2,1H3
InChIKey YQWZSNYMAHXQNF-UHFFFAOYSA-N
Mol Weight 349.39 g/mol
Molecular Formula C14H14F3NO2S2
Exact Mass 349.041806 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DQnuKXmPHXd
Name 1-PHENYL-1-(O-BUTYLDITHIOCARBONATO)-2,2,2-TRIFLUOROETHYLISOCYANATE
Comments ;BS-467 (TESLA)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C14H14F3NO2S2
InChI InChI=1S/C14H14F3NO2S2/c1-2-3-9-20-12(21)22-13(18-10-19,14(15,16)17)11-7-5-4-6-8-11/h4-8H,2-3,9H2,1H3
InChIKey YQWZSNYMAHXQNF-UHFFFAOYSA-N
Instrument Name SEE COMMENT
Literature Reference M.V.VOVK, M.M.BRETSKO, V.I.DOROKHOV (1989) Zhurn.Org.Khim.(Russ. Lang.): v.25,N4, 759-764.
NMR Standard CF3COOH
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CCl4 carbon tetrachl