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Ethyl Cyano[5-(4-chlorophenyl)-3H-1,2,4-dithiazol-3-ylidene]acetate
SpectraBase Compound ID H3856LbgJrr
InChI InChI=1S/C13H9ClN2O2S2/c1-2-18-13(17)10(7-15)12-16-11(19-20-12)8-3-5-9(14)6-4-8/h3-6H,2H2,1H3/b12-10+
InChIKey JMZXEJNFPTYNDZ-ZRDIBKRKSA-N
Mol Weight 324.8 g/mol
Molecular Formula C13H9ClN2O2S2
Exact Mass 323.979398 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hv8ZWyAIzgT
Name Ethyl Cyano[5-(4-chlorophenyl)-3H-1,2,4-dithiazol-3-ylidene]acetate
Alternate Name(s) Ethyl (2E)-[5-(4-chlorophenyl)-3H-1,2,4-dithiazol-3-ylidene](cyano)ethanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H9ClN2O2S2
InChI InChI=1S/C13H9ClN2O2S2/c1-2-18-13(17)10(7-15)12-16-11(19-20-12)8-3-5-9(14)6-4-8/h3-6H,2H2,1H3/b12-10+
InChIKey JMZXEJNFPTYNDZ-ZRDIBKRKSA-N
Molecular Weight 324.800 g/mol
SMILES C(\C(=C\1SSC(=N1)c1ccc(cc1)Cl)C#N)(=O)OCC
SPLASH splash10-000i-0924000000-8f8e1ce7e2a94e18a7bb
Source of Spectrum O1-60-2282-14
Wiley ID 1592188