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JDRCAVANMMHARY-UHFFFAOYSA-N
SpectraBase Compound ID 9daLlZBTuYz
InChI InChI=1S/C13H14ClNO3S2/c1-2-18-11(16)13(17)8-20-12(19)15(13)7-9-3-5-10(14)6-4-9/h3-6,17H,2,7-8H2,1H3
InChIKey JDRCAVANMMHARY-UHFFFAOYSA-N
Mol Weight 331.83 g/mol
Molecular Formula C13H14ClNO3S2
Exact Mass 331.010363 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2DsN6pXmTI
Name Ethyl 3-(4'-chlorobenzyl)-4-hydroxy-2-thioxo-1,3-thiazolane-4-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14ClNO3S2
InChI InChI=1S/C13H14ClNO3S2/c1-2-18-11(16)13(17)8-20-12(19)15(13)7-9-3-5-10(14)6-4-9/h3-6,17H,2,7-8H2,1H3
InChIKey JDRCAVANMMHARY-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cjoc.200690073
Molecular Weight 331.832 g/mol
SMILES OC1(N(C(=S)SC1)Cc1ccc(cc1)Cl)C(=O)OCC
SPLASH splash10-003r-1902000000-82f2189943d9f70167d8
Source of Spectrum CJC-24-383-7c
Synonyms 3-[(4-chlorophenyl)methyl]-4-hydroxy-2-sulfanylidene-4-thiazolidinecarboxylic acid ethyl ester Ethyl 3-(4-chlorobenzyl)-4-hydroxy-2-thioxothiazolidine-4-carboxylate Ethyl 3-[(4-chlorophenyl)methyl]-4-hydroxy-2-sulfanylidene-1,3-thiazolidine-4-carboxylate Ethyl 3-[(4-chlorophenyl)methyl]-4-hydroxy-2-thioxo-thiazolidine-4-carboxylate Ethyl 3-[(4-chlorophenyl)methyl]-4-oxidanyl-2-sulfanylidene-1,3-thiazolidine-4-carboxylate
Wiley ID 1774251