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Thiophene-2-carboxylic acid, 4-isopropylsulfonyl-5-methylsulfonyl-, methyl ester
SpectraBase Compound ID GoP2WyGFut3
InChI InChI=1S/C10H14O6S3/c1-6(2)19(14,15)8-5-7(9(11)16-3)17-10(8)18(4,12)13/h5-6H,1-4H3
InChIKey CLWQWPBGQPAFQZ-UHFFFAOYSA-N
Mol Weight 326.4 g/mol
Molecular Formula C10H14O6S3
Exact Mass 325.995252 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GPe3TyrD5hv
Name Thiophene-2-carboxylic acid, 4-isopropylsulfonyl-5-methylsulfonyl-, methyl ester
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Formula C10H14O6S3
InChI InChI=1S/C10H14O6S3/c1-6(2)19(14,15)8-5-7(9(11)16-3)17-10(8)18(4,12)13/h5-6H,1-4H3
InChIKey CLWQWPBGQPAFQZ-UHFFFAOYSA-N
Molecular Weight 326.396 g/mol
SMILES c1(c(sc(c1)C(OC)=O)S(C)(=O)=O)S(C(C)C)(=O)=O
SPLASH splash10-0006-9520000000-ab5bdadab37ba189aab0
Source of Spectrum AD-0-2532-0
Synonyms 4-isopropylsulfonyl-5-mesyl-thiophene-2-carboxylic acid methyl ester 5-Methylsulfonyl-4-propan-2-ylsulfonyl-2-thiophenecarboxylic acid methyl ester Methyl 4-(isopropylsulfonyl)-5-(methylsulfonyl)-2-thiophenecarboxylate Methyl 4-isopropylsulfonyl-5-methylsulfonyl-thiophene-2-carboxylate Methyl 5-methylsulfonyl-4-propan-2-ylsulfonyl-thiophene-2-carboxylate
Wiley ID 1426299