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5-Bromo-2-[hydroxy(phenyl)methyl]-3-thiophenecarboxylic acid ethyl ester
SpectraBase Compound ID HGgk2hB7AF
InChI InChI=1S/C14H13BrO3S/c1-2-18-14(17)10-8-11(15)19-13(10)12(16)9-6-4-3-5-7-9/h3-8,12,16H,2H2,1H3
InChIKey WVOLRBBCFXPQFS-UHFFFAOYSA-N
Mol Weight 341.22 g/mol
Molecular Formula C14H13BrO3S
Exact Mass 339.976878 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BUVbuRWvSMz
Name 5-Bromo-2-[hydroxy(phenyl)methyl]-3-thiophenecarboxylic acid ethyl ester
Alternate Name(s) Ethyl 5-bromanyl-2-[oxidanyl(phenyl)methyl]thiophene-3-carboxylate Ethyl 5-bromo-2-[hydroxy(phenyl)methyl]thiophene-3-carboxylate
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Formula C14H13BrO3S
InChI InChI=1S/C14H13BrO3S/c1-2-18-14(17)10-8-11(15)19-13(10)12(16)9-6-4-3-5-7-9/h3-8,12,16H,2H2,1H3
InChIKey WVOLRBBCFXPQFS-UHFFFAOYSA-N
Molecular Weight 341.219 g/mol
SMILES OC(c1c(cc(s1)Br)C(=O)OCC)c1ccccc1
SPLASH splash10-0005-0092000000-6bc094c99df07b6632c8
Source of Spectrum J-65-4630-20
Wiley ID 1532888