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2-(4-Chlorophenoxy)carbothioyl-5-keto-4-methyl-3-isoxazoline-3-carboxylic acid ethyl ester
SpectraBase Compound ID Kvwhve33zp4
InChI InChI=1S/C14H12ClNO5S/c1-3-19-13(18)11-8(2)12(17)21-16(11)14(22)20-10-6-4-9(15)5-7-10/h4-7H,3H2,1-2H3
InChIKey BINCSJJFZWIPFO-UHFFFAOYSA-N
Mol Weight 341.77 g/mol
Molecular Formula C14H12ClNO5S
Exact Mass 341.012471 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5LKq7X8UT1b
Name 2-(4-Chlorophenoxy)carbothioyl-5-keto-4-methyl-3-isoxazoline-3-carboxylic acid ethyl ester
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Formula C14H12ClNO5S
InChI InChI=1S/C14H12ClNO5S/c1-3-19-13(18)11-8(2)12(17)21-16(11)14(22)20-10-6-4-9(15)5-7-10/h4-7H,3H2,1-2H3
InChIKey BINCSJJFZWIPFO-UHFFFAOYSA-N
Molecular Weight 341.765 g/mol
SMILES C=1(N(OC(C1C)=O)C(Oc1ccc(cc1)Cl)=S)C(=O)OCC
SPLASH splash10-0059-0910000000-f06bcc74ec557151eac7
Source of Spectrum KC-0-2676-11
Synonyms 2-[(4-chlorophenoxy)-sulfanylidenemethyl]-4-methyl-5-oxo-3-isoxazolecarboxylic acid ethyl ester Ethyl 2-(4-chloranylphenoxy)carbothioyl-4-methyl-5-oxidanylidene-1,2-oxazole-3-carboxylate Ethyl 2-(4-chlorophenoxy)carbothioyl-4-methyl-5-oxo-1,2-oxazole-3-carboxylate Ethyl 2-(4-chlorophenoxy)carbothioyl-4-methyl-5-oxo-isoxazole-3-carboxylate
Wiley ID 823488