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1H-Pyrrole-1-propanoic acid, .alpha.-[4-(phenylmethoxy)phenyl]-, (.+-.)-
SpectraBase Compound ID KeFiR3sZCd4
InChI InChI=1S/C20H19NO3/c22-20(23)19(14-21-12-4-5-13-21)17-8-10-18(11-9-17)24-15-16-6-2-1-3-7-16/h1-13,19H,14-15H2,(H,22,23)
InChIKey CERBNEGPRJBPKL-UHFFFAOYSA-N
Mol Weight 321.38 g/mol
Molecular Formula C20H19NO3
Exact Mass 321.136493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DlxpD8utKAb
Name 1H-Pyrrole-1-propanoic acid, .alpha.-[4-(phenylmethoxy)phenyl]-, (.+-.)-
Alternate Name(s) 2-(4'-Benzyloxyphenyl)-3-(pyrrol-1''-yl)propionic 2-[4-(benzyloxy)phenyl]-3-(1H-pyrrol-1-yl)propanoic acid 2-(4-phenylmethoxyphenyl)-3-(1-pyrrolyl)propanoic acid 2-(4-phenylmethoxyphenyl)-3-pyrrol-1-ylpropanoic acid 2-(4-benzyloxyphenyl)-3-pyrrol-1-yl-propanoic acid 2-(4-phenylmethoxyphenyl)-3-pyrrol-1-yl-propanoic acid
CAS Registry Number 111751-80-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H19NO3
InChI InChI=1S/C20H19NO3/c22-20(23)19(14-21-12-4-5-13-21)17-8-10-18(11-9-17)24-15-16-6-2-1-3-7-16/h1-13,19H,14-15H2,(H,22,23)
InChIKey CERBNEGPRJBPKL-UHFFFAOYSA-N
Molecular Weight 321.376 g/mol
SMILES OC(C(C[n]1cccc1)c1ccc(OCc2ccccc2)cc1)=O
SPLASH splash10-000x-9001000000-cd530a73573a5569bdc2
Source of Spectrum H-69-2055-3
Wiley ID 1321057