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3-[1-(2-methoxyphenyl)-5-(4-methylphenyl)-1H-pyrrol-2-yl]propanoic acid
SpectraBase Compound ID EhdQmW1W35E
InChI InChI=1S/C21H21NO3/c1-15-7-9-16(10-8-15)18-13-11-17(12-14-21(23)24)22(18)19-5-3-4-6-20(19)25-2/h3-11,13H,12,14H2,1-2H3,(H,23,24)
InChIKey WUSDIPVLPKKNJP-UHFFFAOYSA-N
Mol Weight 335.4 g/mol
Molecular Formula C21H21NO3
Exact Mass 335.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Stvy9V3BUm
Name 3-[1-(2-methoxyphenyl)-5-(4-methylphenyl)-1H-pyrrol-2-yl]propanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H21NO3
InChI InChI=1S/C21H21NO3/c1-15-7-9-16(10-8-15)18-13-11-17(12-14-21(23)24)22(18)19-5-3-4-6-20(19)25-2/h3-11,13H,12,14H2,1-2H3,(H,23,24)
InChIKey WUSDIPVLPKKNJP-UHFFFAOYSA-N
Molecular Weight 335.403 g/mol
SMILES OC(CCc1[n](c(cc1)-c1ccc(C)cc1)-c1c(OC)cccc1)=O
SPLASH splash10-004i-2981000000-95de2bdbbf5393e02cd3
Synonyms 3-[1-(2-methoxyphenyl)-5-(4-methylphenyl)-2-pyrrolyl]propanoic acid 3-[1-(2-methoxyphenyl)-5-(4-methylphenyl)pyrrol-2-yl]propanoic acid 3-[1-(2-methoxyphenyl)-5-(p-tolyl)pyrrol-2-yl]propanoic acid 3-[1-(2-methoxyphenyl)-5-(p-tolyl)pyrrol-2-yl]propionic acid
Wiley ID 1443168