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3-[1-(3-methoxyphenyl)-5-(2-thienyl)pyrrol-2-yl]propanoic acid
SpectraBase Compound ID C5rS5BzlsWk
InChI InChI=1S/C18H17NO3S/c1-22-15-5-2-4-14(12-15)19-13(8-10-18(20)21)7-9-16(19)17-6-3-11-23-17/h2-7,9,11-12H,8,10H2,1H3,(H,20,21)
InChIKey NBSYVIIGSUZAOD-UHFFFAOYSA-N
Mol Weight 327.4 g/mol
Molecular Formula C18H17NO3S
Exact Mass 327.092915 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1MXiTYU1Vs0
Name 3-[1-(3-methoxyphenyl)-5-(2-thienyl)pyrrol-2-yl]propanoic acid
Alternate Name(s) 3-[1-(3-methoxyphenyl)-5-(2-thienyl)pyrrol-2-yl]propionic acid 3-[1-(3-methoxyphenyl)-5-thiophen-2-yl-2-pyrrolyl]propanoic acid 3-[1-(3-methoxyphenyl)-5-thiophen-2-yl-pyrrol-2-yl]propanoic acid Propionic acid, 3-[1-(3-methoxyphenyl)-5-thiophen-2-yl-1H-pyrrol-2-yl]-
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Formula C18H17NO3S
InChI InChI=1S/C18H17NO3S/c1-22-15-5-2-4-14(12-15)19-13(8-10-18(20)21)7-9-16(19)17-6-3-11-23-17/h2-7,9,11-12H,8,10H2,1H3,(H,20,21)
InChIKey NBSYVIIGSUZAOD-UHFFFAOYSA-N
Molecular Weight 327.398 g/mol
SMILES OC(CCc1[n](c(cc1)-c1sccc1)-c1cc(OC)ccc1)=O
SPLASH splash10-014i-1491000000-20cc326340b23953716e
Wiley ID 1439781