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Ethyl (2Z,3E)-4-cyano-3-(methylsulfanyl)-[4-(p-tolyl)sulfonyl]-2-(1H-pyrid-2'-ylidene)-butenoate
SpectraBase Compound ID C14NqaK9A2s
InChI InChI=1S/C20H20N2O4S2/c1-4-26-20(23)18(16-7-5-6-12-22-16)19(27-3)17(13-21)28(24,25)15-10-8-14(2)9-11-15/h5-12,22H,4H2,1-3H3/b18-16-,19-17-
InChIKey MNUHTOQLLBMTDP-YGGBKCGDSA-N
Mol Weight 416.51 g/mol
Molecular Formula C20H20N2O4S2
Exact Mass 416.086449 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1rYOkYcIBJn
Name Ethyl (2Z,3E)-4-cyano-3-(methylsulfanyl)-[4-(p-tolyl)sulfonyl]-2-(1H-pyrid-2'-ylidene)-butenoate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20N2O4S2
InChI InChI=1S/C20H20N2O4S2/c1-4-26-20(23)18(16-7-5-6-12-22-16)19(27-3)17(13-21)28(24,25)15-10-8-14(2)9-11-15/h5-12,22H,4H2,1-3H3/b18-16-,19-17-
InChIKey MNUHTOQLLBMTDP-YGGBKCGDSA-N
Molecular Weight 416.510 g/mol
SMILES N1C=CC=C\C1=C\(\C(=C/(S(c1ccc(C)cc1)(=O)=O)C#N)SC)C(=O)OCC
SPLASH splash10-03xr-1290000000-63d9e344df2bd0ecf4c8
Source of Spectrum U1-2009-5852-5dand6d
Wiley ID 1697443