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1H-Pyrrole-1-propanoic acid, .alpha.-phenyl-, ethyl ester, (.+-.)-
SpectraBase Compound ID AdxU43p08fl
InChI InChI=1S/C15H17NO2/c1-2-18-15(17)14(12-16-10-6-7-11-16)13-8-4-3-5-9-13/h3-11,14H,2,12H2,1H3
InChIKey WQXVHSPQRCRMNN-UHFFFAOYSA-N
Mol Weight 243.31 g/mol
Molecular Formula C15H17NO2
Exact Mass 243.125929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2EghDfJmPfU
Name 1H-Pyrrole-1-propanoic acid, .alpha.-phenyl-, ethyl ester, (.+-.)-
CAS Registry Number 111751-77-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H17NO2
InChI InChI=1S/C15H17NO2/c1-2-18-15(17)14(12-16-10-6-7-11-16)13-8-4-3-5-9-13/h3-11,14H,2,12H2,1H3
InChIKey WQXVHSPQRCRMNN-UHFFFAOYSA-N
Molecular Weight 243.306 g/mol
SMILES C(C(=O)OCC)(C[n]1cccc1)c1ccccc1
SPLASH splash10-001l-9150000000-f6cf1834ff7e9396e4c7
Source of Spectrum H-69-2054-0
Synonyms Ethyl 2-phenyl-3-(1H-pyrrol-1-yl)propanoate Ethyl 2-phenyl-3-(pyrrol-1''-yl)-propionate 2-Phenyl-3-(1-pyrrolyl)propanoic acid ethyl ester Ethyl 2-phenyl-3-pyrrol-1-ylpropanoate Ethyl 2-phenyl-3-pyrrol-1-yl-propanoate
Wiley ID 1246164