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5-[(E)-2-(2,4-dichlorophenyl)ethenyl]-3-(methylthio)isoxazole
SpectraBase Compound ID 1x6gzmuYVwY
InChI InChI=1S/C12H9Cl2NOS/c1-17-12-7-10(16-15-12)5-3-8-2-4-9(13)6-11(8)14/h2-7H,1H3/b5-3+
InChIKey YHXJTBDXXRRDIZ-HWKANZROSA-N
Mol Weight 286.18 g/mol
Molecular Formula C12H9Cl2NOS
Exact Mass 284.97819 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FcLnJ1vB053
Name 5-[(E)-2-(2,4-dichlorophenyl)ethenyl]-3-(methylthio)isoxazole
Alternate Name(s) 5-[(E)-2-(2,4-dichlorophenyl)ethenyl]-3-methylsulfanyl-1,2-oxazole 5-[(E)-2-(2,4-dichlorophenyl)vinyl]-3-(methylthio)isoxazole 5-[(E)-2-(2,4-dichlorophenyl)vinyl]-3-methylsulfanyl-isoxazole
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Formula C12H9Cl2NOS
InChI InChI=1S/C12H9Cl2NOS/c1-17-12-7-10(16-15-12)5-3-8-2-4-9(13)6-11(8)14/h2-7H,1H3/b5-3+
InChIKey YHXJTBDXXRRDIZ-HWKANZROSA-N
Molecular Weight 286.176 g/mol
SMILES c1(noc(c1)\C=C\c1c(cc(cc1)Cl)Cl)SC
SPLASH splash10-00di-0590000000-3beb22668d45a6409206
Source of Spectrum Y-28-1345-3
Wiley ID 1288724