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2-CYANO-3-PHENYL-5,5-BIS-(METHYLTHIO)-PENTA-2,4-DIENENITRILE
SpectraBase Compound ID 9gs3GcsPBQQ
InChI InChI=1S/C14H12N2S2/c1-17-14(18-2)8-13(12(9-15)10-16)11-6-4-3-5-7-11/h3-8H,1-2H3
InChIKey WFOZCGRIXYRGGN-UHFFFAOYSA-N
Mol Weight 272.38 g/mol
Molecular Formula C14H12N2S2
Exact Mass 272.044191 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5hTS2ynxkZT
Name 2-Cyano-3-phenyl-5,5-bis(methylthio)-2,4-pentadiene-1-nitrile
CAS Registry Number 64608-21-5
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C14H12N2S2
InChI InChI=1S/C14H12N2S2/c1-17-14(18-2)8-13(12(9-15)10-16)11-6-4-3-5-7-11/h3-8H,1-2H3
InChIKey WFOZCGRIXYRGGN-UHFFFAOYSA-N
Instrument Name Tesla BS477
Literature Reference M. Michalik, K. Peseke, R. Radeglia, J. Prakt. Chem. 327, 103 (1985).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3