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(Z)-3-(4-Tolyl)-2-(2,3,3-trichloro-1-nitroallylidene)thiazolidin-4-one
SpectraBase Compound ID CDChlOkZ02A
InChI InChI=1S/C13H9Cl3N2O3S/c1-7-2-4-8(5-3-7)17-9(19)6-22-13(17)11(18(20)21)10(14)12(15)16/h2-5H,6H2,1H3/b13-11-
InChIKey HYLFWCNHNCDAPV-QBFSEMIESA-N
Mol Weight 379.65 g/mol
Molecular Formula C13H9Cl3N2O3S
Exact Mass 377.939946 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CEolmZb5E3Y
Name (Z)-3-(4-Tolyl)-2-(2,3,3-trichloro-1-nitroallylidene)thiazolidin-4-one
Appearance Brown solid
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Formula C13H9Cl3N2O3S
InChI InChI=1S/C13H9Cl3N2O3S/c1-7-2-4-8(5-3-7)17-9(19)6-22-13(17)11(18(20)21)10(14)12(15)16/h2-5H,6H2,1H3/b13-11-
InChIKey HYLFWCNHNCDAPV-QBFSEMIESA-N
Instrument Name Hewlett Packard 'MS 5989B'
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.10.170
Molecular Weight 379.645 g/mol
Reported Formula C13H9Cl3N2O3S
SMILES c1(N2\C(SCC2=O)=C/(C(=C(Cl)Cl)Cl)[N+]([O-])=O)ccc(cc1)C
SPLASH splash10-0016-9580000000-c924dd6d5458062d5fb8
Source of Spectrum BJO-10-SM6-15
Wiley ID 1853911