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1H-Pyrrole-1-propanoic acid, .alpha.-[4-(acetyloxy)phenyl]-, (.+-.)-
SpectraBase Compound ID 4VVMevWjsds
InChI InChI=1S/C15H15NO4/c1-11(17)20-13-6-4-12(5-7-13)14(15(18)19)10-16-8-2-3-9-16/h2-9,14H,10H2,1H3,(H,18,19)
InChIKey CMHXAAABWLQRPE-UHFFFAOYSA-N
Mol Weight 273.29 g/mol
Molecular Formula C15H15NO4
Exact Mass 273.100108 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LN8b1C3OINM
Name 1H-Pyrrole-1-propanoic acid, .alpha.-[4-(acetyloxy)phenyl]-, (.+-.)-
CAS Registry Number 111751-82-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H15NO4
InChI InChI=1S/C15H15NO4/c1-11(17)20-13-6-4-12(5-7-13)14(15(18)19)10-16-8-2-3-9-16/h2-9,14H,10H2,1H3,(H,18,19)
InChIKey CMHXAAABWLQRPE-UHFFFAOYSA-N
Molecular Weight 273.288 g/mol
SMILES OC(C(C[n]1cccc1)c1ccc(OC(=O)C)cc1)=O
SPLASH splash10-001i-9000000000-51d0718a02ae234fdff5
Source of Spectrum H-69-2055-3
Synonyms 2-(4'-Acetoxyphenyl)-3-(pyrrol-1''-yl)propionic acid 2-[4-(acetyloxy)phenyl]-3-(1H-pyrrol-1-yl)propanoic acid 2-(4-acetyloxyphenyl)-3-(1-pyrrolyl)propanoic acid 2-(4-acetyloxyphenyl)-3-pyrrol-1-ylpropanoic acid 2-(4-acetoxyphenyl)-3-pyrrol-1-yl-propanoic acid 2-(4-acetyloxyphenyl)-3-pyrrol-1-yl-propanoic acid
Wiley ID 1277223