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5,6-DICYANO-4,7-DIETHYLBENZO-[1,2,3]-TRITHIOLE
SpectraBase Compound ID FpHCLy6TpIT
InChI InChI=1S/C12H10N2S3/c1-3-7-9(5-13)10(6-14)8(4-2)12-11(7)15-17-16-12/h3-4H2,1-2H3
InChIKey JSMHRHRXNISTIS-UHFFFAOYSA-N
Mol Weight 278.41 g/mol
Molecular Formula C12H10N2S3
Exact Mass 278.000612 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9LF6ke7UxRB
Name 5,6-DICYANO-4,7-DIETHYLBENZO-[1,2,3]-TRITHIOLE
Compound Number 2A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H10N2S3
InChI InChI=1S/C12H10N2S3/c1-3-7-9(5-13)10(6-14)8(4-2)12-11(7)15-17-16-12/h3-4H2,1-2H3
InChIKey JSMHRHRXNISTIS-UHFFFAOYSA-N
Literature Reference Author T.KIMURA,A.YOMOGITA,T.MATSUTANI,T.SUZUKI,I.TANAKA,Y.KAWAI,Y. TAKAGUCHI,T.WAKAHARA
Literature Reference Citation J.ORG.CHEM.,69,4716(2004)
Literature Reference DOI 10.1021/jo030354j
Molecular Weight 278.405 g/mol
Solvent CDCl3
Source File Reference UWVN22028