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1PXHizSi5ru
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1PXHizSi5ru
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2-[4-(2-Chloro-6-fluoro-benzyl)oxy-3-methoxy-phenyl]thiazolidin-3-ium-4-carboxylate
SpectraBase Compound ID A9thkTG0IrT
InChI InChI=1S/C18H17ClFNO4S/c1-24-16-7-10(17-21-14(9-26-17)18(22)23)5-6-15(16)25-8-11-12(19)3-2-4-13(11)20/h2-7,14,17,21H,8-9H2,1H3,(H,22,23)
InChIKey JSSARJZMIKOZJM-UHFFFAOYSA-N
Mol Weight 397.85 g/mol
Molecular Formula C18H17ClFNO4S
Exact Mass 397.055085 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1PXHizSi5ru
Name 2-[4-(2-chloro-6-fluoro-benzyl)oxy-3-methoxy-phenyl]thiazolidin-3-ium-4-carboxylate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17ClFNO4S
InChI InChI=1S/C18H17ClFNO4S/c1-24-16-7-10(17-21-14(9-26-17)18(22)23)5-6-15(16)25-8-11-12(19)3-2-4-13(11)20/h2-7,14,17,21H,8-9H2,1H3,(H,22,23)
InChIKey JSSARJZMIKOZJM-UHFFFAOYSA-N
Molecular Weight 397.848 g/mol
SMILES N1C(SCC1C(=O)O)c1cc(OC)c(OCc2c(F)cccc2Cl)cc1
SPLASH splash10-0006-4911000000-4e9e0c888156bc960283
Synonyms 2-[4-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]-3-methoxy-phenyl]-1,3-thiazolidin-3-ium-4-carboxylate 2-[4-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]-3-methoxy-phenyl]-1,3-thiazolidine-4-carboxylic acid 2-[4-[(2-chloro-6-fluoro-phenyl)methoxy]-3-methoxy-phenyl]thiazolidin-3-ium-4-carboxylate 2-[4-[(2-chloro-6-fluoro-phenyl)methoxy]-3-methoxy-phenyl]thiazolidine-4-carboxylic acid 2-[4-[(2-chloro-6-fluorophenyl)methoxy]-3-methoxyphenyl]-1,3-thiazolidin-3-ium-4-carboxylate 2-[4-[(2-chloro-6-fluorophenyl)methoxy]-3-methoxyphenyl]-1,3-thiazolidine-4-carboxylic acid 2-[4-[(2-chloro-6-fluorophenyl)methoxy]-3-methoxyphenyl]-4-thiazolidin-3-iumcarboxylate 2-[4-[(2-chloro-6-fluorophenyl)methoxy]-3-methoxyphenyl]-4-thiazolidinecarboxylic acid 2-{4-[(2-chloro-6-fluorobenzyl)oxy]-3-methoxyphenyl}-1,3-thiazolidine-4-carboxylic acid
Wiley ID 1461876
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