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2-(4-Fluoro-phenyl)-amino-5-phenyl-thiazolo(2,3-B)-1,3,4-thiadiazol-4-ium cation

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2-(4-Fluoro-phenyl)-amino-5-phenyl-thiazolo(2,3-B)-1,3,4-thiadiazol-4-ium cation
SpectraBase Compound ID CewlaCLYpHG
InChI InChI=1S/C16H11FN3S2/c17-12-6-8-13(9-7-12)18-15-19-20-14(10-21-16(20)22-15)11-4-2-1-3-5-11/h1-10H,(H,18,19)/q+1
InChIKey YHBNSBRXEYKVLP-UHFFFAOYSA-N
Mol Weight 328.4 g/mol
Molecular Formula C16H11FN3S2
Exact Mass 328.037843 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EtVq5aHyldt
Name 2-(4-Fluoro-phenyl)-amino-5-phenyl-thiazolo(2,3-B)-1,3,4-thiadiazol-4-ium cation
Comments tetrafluoroborate
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C16H11FN3S2
InChI InChI=1S/C16H11FN3S2/c17-12-6-8-13(9-7-12)18-15-19-20-14(10-21-16(20)22-15)11-4-2-1-3-5-11/h1-10H,(H,18,19)/q+1
InChIKey YHBNSBRXEYKVLP-UHFFFAOYSA-N
Instrument Name Bruker AC-200
Literature Reference P. Molina, A. Arques, A. Alias, Tetrahedron 48, 1285 (1992).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6