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(E/Z)-Ethyl 2-(4-chloro-5H-1,2,3-dithiazole-5-ylidene)-2'-fluorobenzoylacetate
SpectraBase Compound ID 3irkXqkaWRr
InChI InChI=1S/C13H9ClFNO3S2/c1-2-19-13(18)9(11-12(14)16-21-20-11)10(17)7-5-3-4-6-8(7)15/h3-6H,2H2,1H3/b11-9+
InChIKey IESRLCRQNKEGAG-PKNBQFBNSA-N
Mol Weight 345.79 g/mol
Molecular Formula C13H9ClFNO3S2
Exact Mass 344.969641 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EKt4ZCnQYMi
Name (E/Z)-Ethyl 2-(4-chloro-5H-1,2,3-dithiazole-5-ylidene)-2'-fluorobenzoylacetate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H9ClFNO3S2
InChI InChI=1S/C13H9ClFNO3S2/c1-2-19-13(18)9(11-12(14)16-21-20-11)10(17)7-5-3-4-6-8(7)15/h3-6H,2H2,1H3/b11-9+
InChIKey IESRLCRQNKEGAG-PKNBQFBNSA-N
Molecular Weight 345.790 g/mol
SMILES C=1(\C(=C\(C(c2c(F)cccc2)=O)C(=O)OCC)SSN1)Cl
SPLASH splash10-001i-1292000000-5c78b8ece4347b03bb42
Source of Spectrum F-55-9656-12
Synonyms Ethyl (2E)-2-(4-chloro-5H-1,2,3-dithiazol-5-ylidene)-3-(2-fluorophenyl)-3-oxopropanoate
Wiley ID 838826