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3-[5-(5-thiophen-2-yl-2-thiophenyl)-2-thiophenyl]propanoic acid
SpectraBase Compound ID It1v5Y9m1Ul
InChI InChI=1S/C15H12O2S3/c16-15(17)8-4-10-3-5-13(19-10)14-7-6-12(20-14)11-2-1-9-18-11/h1-3,5-7,9H,4,8H2,(H,16,17)
InChIKey JRGWHFAZTXVDTM-UHFFFAOYSA-N
Mol Weight 320.44 g/mol
Molecular Formula C15H12O2S3
Exact Mass 319.999943 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ImNjuSnybMu
Name 3-[5-(5-thiophen-2-yl-2-thiophenyl)-2-thiophenyl]propanoic acid
Alternate Name(s) 3-[5-[5-(2-thienyl)-2-thienyl]-2-thienyl]propanoic acid 3-[5-[5-(2-thienyl)-2-thienyl]-2-thienyl]propionic acid
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Formula C15H12O2S3
InChI InChI=1S/C15H12O2S3/c16-15(17)8-4-10-3-5-13(19-10)14-7-6-12(20-14)11-2-1-9-18-11/h1-3,5-7,9H,4,8H2,(H,16,17)
InChIKey JRGWHFAZTXVDTM-UHFFFAOYSA-N
Molecular Weight 320.439 g/mol
SMILES OC(CCc1sc(-c2sc(-c3sccc3)cc2)cc1)=O
SPLASH splash10-03k9-0096000000-0a2732939cfe9db306f0
Source of Spectrum Y-28-414-14
Wiley ID 1319818