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3-AMINO-4,6-DICYANO-5-PHENYL-2-(TETRAHYDROTHIOPHENIO)-PHENOLATE
SpectraBase Compound ID 2nUZkynYJHJ
InChI InChI=1S/C18H15N3OS/c19-10-13-15(12-6-2-1-3-7-12)14(11-20)17(22)18(16(13)21)23-8-4-5-9-23/h1-3,6-7H,4-5,8-9,21H2
InChIKey APZRNFROXBTUSW-UHFFFAOYSA-N
Mol Weight 321.4 g/mol
Molecular Formula C18H15N3OS
Exact Mass 321.093583 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D8jq3xq11Tf
Name 3-AMINO-4,6-DICYANO-5-PHENYL-2-(TETRAHYDROTHIOPHENIO)-PHENOLATE
Compound Number 3D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H15N3OS
InChI InChI=1S/C18H15N3OS/c19-10-13-15(12-6-2-1-3-7-12)14(11-20)17(22)18(16(13)21)23-8-4-5-9-23/h1-3,6-7H,4-5,8-9,21H2
InChIKey APZRNFROXBTUSW-UHFFFAOYSA-N
Literature Reference Author K.GEWALD,M.REHWALD,K.ECKERT,H.SCHAEFER,M.GRUNER
Literature Reference Citation MH.CHEM.,126,711(1995)
Literature Reference DOI 10.1007/BF00807162
Molecular Weight 321.397 g/mol
Solvent DMSO-D6
Source File Reference UWPB8