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Isothiazole-4-carboxylic acid, 3-[2-(3,4,5-trimethoxyphenyl)ethyl]-, methyl ester
SpectraBase Compound ID 7ZIZEotCohb
InChI InChI=1S/C16H19NO5S/c1-19-13-7-10(8-14(20-2)15(13)21-3)5-6-12-11(9-23-17-12)16(18)22-4/h7-9H,5-6H2,1-4H3
InChIKey YDTATVGUCFTYOQ-UHFFFAOYSA-N
Mol Weight 337.39 g/mol
Molecular Formula C16H19NO5S
Exact Mass 337.098394 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5P42cJ8bwof
Name Isothiazole-4-carboxylic acid, 3-[2-(3,4,5-trimethoxyphenyl)ethyl]-, methyl ester
Alternate Name(s) 3-[2-(3,4,5-trimethoxyphenyl)ethyl]-4-isothiazolecarboxylic acid methyl ester 3-[2-(3,4,5-trimethoxyphenyl)ethyl]isothiazole-4-carboxylic acid methyl ester Methyl 3-[2-(3,4,5-trimethoxyphenyl)ethyl]-1,2-thiazole-4-carboxylate Methyl 3-[2-(3,4,5-trimethoxyphenyl)ethyl]isothiazole-4-carboxylate
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Formula C16H19NO5S
InChI InChI=1S/C16H19NO5S/c1-19-13-7-10(8-14(20-2)15(13)21-3)5-6-12-11(9-23-17-12)16(18)22-4/h7-9H,5-6H2,1-4H3
InChIKey YDTATVGUCFTYOQ-UHFFFAOYSA-N
Molecular Weight 337.390 g/mol
SMILES c1(c(nsc1)CCc1cc(OC)c(c(c1)OC)OC)C(=O)OC
SPLASH splash10-001i-6901000000-07601a70830e6b1b227f
Wiley ID 1437277