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1-(BENZOTHIAZOL-2-YLTHIO)-1-PHENYL-2,2,2-TRIFLUOROETHYLISOCYANATE
SpectraBase Compound ID ALmXJEEHW1F
InChI InChI=1S/C16H9F3N2OS2/c17-16(18,19)15(20-10-22,11-6-2-1-3-7-11)24-14-21-12-8-4-5-9-13(12)23-14/h1-9H
InChIKey SCYCYLWVPQGREP-UHFFFAOYSA-N
Mol Weight 366.38 g/mol
Molecular Formula C16H9F3N2OS2
Exact Mass 366.01084 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ArHU6C8yk5I
Name 1-(BENZOTHIAZOL-2-YLTHIO)-1-PHENYL-2,2,2-TRIFLUOROETHYLISOCYANATE
Comments SCALE INVERTED;WP-200 (BRUKER)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C16H9F3N2OS2
InChI InChI=1S/C16H9F3N2OS2/c17-16(18,19)15(20-10-22,11-6-2-1-3-7-11)24-14-21-12-8-4-5-9-13(12)23-14/h1-9H
InChIKey SCYCYLWVPQGREP-UHFFFAOYSA-N
Instrument Name SEE COMMENT
Literature Reference M.V.VOVK, YU.N.DAVIDYUK, L.I.SAMARAI (1991) Zhurn.Org.Khim.(Russ. Lang.): v.27,N7, 1480-1486.
NMR Standard CCl3F
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C3D6O acetone-d6