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2-Thiophenecarboxylic acid, 3-hydroxy-5-methyl-, methyl ester
SpectraBase Compound ID IkEvRvC5nvS
InChI InChI=1S/C7H8O3S/c1-4-3-5(8)6(11-4)7(9)10-2/h3,8H,1-2H3
InChIKey PLTCMJBEOCSRII-UHFFFAOYSA-N
Mol Weight 172.2 g/mol
Molecular Formula C7H8O3S
Exact Mass 172.019415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Hyzkdx190f
Name 2-Thiophenecarboxylic acid, 3-hydroxy-5-methyl-, methyl ester
Alternate Name(s) Methyl 3-hydroxy-5-methyl-2-thiophenecarboxylate Methyl 3-hydroxy-5-methylthiophene-2-carboxylate 3-Hydroxy-5-methyl-2-thiophenecarboxylic acid methyl ester Methyl 3-hydroxy-5-methyl-thiophene-2-carboxylate Methyl 5-methyl-3-oxidanyl-thiophene-2-carboxylate
CAS Registry Number 5556-22-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H8O3S
InChI InChI=1S/C7H8O3S/c1-4-3-5(8)6(11-4)7(9)10-2/h3,8H,1-2H3
InChIKey PLTCMJBEOCSRII-UHFFFAOYSA-N
Molecular Weight 172.198 g/mol
SMILES Oc1cc(C)sc1C(=O)OC
SPLASH splash10-0006-4900000000-f6db38693d283d3ab61f
Source of Spectrum T-66-300-0
Wiley ID 16009