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ETHYL-3-(4-CHLOROBENZYL)-4-OXO-2-THIOXO-1,3-THIAZOLANE-5-CARBOXYLATE
SpectraBase Compound ID JlhF6jgvWf3
InChI InChI=1S/C13H12ClNO3S2/c1-2-18-12(17)10-11(16)15(13(19)20-10)7-8-3-5-9(14)6-4-8/h3-6,10H,2,7H2,1H3
InChIKey HBXAJQJUBBYMEE-UHFFFAOYSA-N
Mol Weight 329.82 g/mol
Molecular Formula C13H12ClNO3S2
Exact Mass 328.994713 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 71JY1vmv2B6
Name Ethyl 3-(p-chlorobenzyl)-4-oxo-2-thioxo-1,3-thiazolane-5-carboxylate
Alternate Name(s) 3-[(4-chlorophenyl)methyl]-4-oxo-2-sulfanylidene-5-thiazolidinecarboxylic acid ethyl ester Ethyl 3-[(4-chlorophenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidine-5-carboxylate Ethyl 3-[(4-chlorophenyl)methyl]-4-oxo-2-thioxo-thiazolidine-5-carboxylate Ethyl 3-[(4-chlorophenyl)methyl]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidine-5-carboxylate
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Formula C13H12ClNO3S2
InChI InChI=1S/C13H12ClNO3S2/c1-2-18-12(17)10-11(16)15(13(19)20-10)7-8-3-5-9(14)6-4-8/h3-6,10H,2,7H2,1H3
InChIKey HBXAJQJUBBYMEE-UHFFFAOYSA-N
Molecular Weight 329.816 g/mol
SMILES C1(N(C(C(S1)C(=O)OCC)=O)Cc1ccc(cc1)Cl)=S
SPLASH splash10-0fb9-3980000000-67884adea9703cbc19d4
Source of Spectrum AH-139-1030-3b
Wiley ID 1695764