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4-METHYL-2-OXO-5-PHENYLHYDRAZONE-DELTA(3)-TIOLEN-3-CARBONITRIL
SpectraBase Compound ID BTcSyTlP3xP
InChI InChI=1S/C17H11N3OS/c18-11-14-15(12-7-3-1-4-8-12)16(22-17(14)21)20-19-13-9-5-2-6-10-13/h1-10,19H/b20-16-
InChIKey PEBDOLQIKDUVSV-SILNSSARSA-N
Mol Weight 305.36 g/mol
Molecular Formula C17H11N3OS
Exact Mass 305.062283 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3y0OsQ725pT
Name 4-METHYL-2-OXO-5-PHENYLHYDRAZONE-DELTA(3)-TIOLEN-3-CARBONITRIL
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H11N3OS
InChI InChI=1S/C17H11N3OS/c18-11-14-15(12-7-3-1-4-8-12)16(22-17(14)21)20-19-13-9-5-2-6-10-13/h1-10,19H/b20-16-
InChIKey PEBDOLQIKDUVSV-SILNSSARSA-N
Literature Reference Author K.GEWALD,M.GRUNER,U.HAIN,G.SUEPTITZ
Literature Reference Citation MH.CHEM.,119,985(1988)
Literature Reference DOI 10.1007/BF00810107
Molecular Weight 305.354 g/mol
Solvent DMSO-D6
Source File Reference UWRU9207