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1H-Pyrrole-1-propanoic acid, .alpha.-(4-nitrophenyl)-, methyl ester, (.+-.)-
SpectraBase Compound ID Gqys3suSfFw
InChI InChI=1S/C14H14N2O4/c1-20-14(17)13(10-15-8-2-3-9-15)11-4-6-12(7-5-11)16(18)19/h2-9,13H,10H2,1H3
InChIKey FXPYLSUYWQHKRI-UHFFFAOYSA-N
Mol Weight 274.28 g/mol
Molecular Formula C14H14N2O4
Exact Mass 274.095357 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3o3sbU70pOK
Name 1H-Pyrrole-1-propanoic acid, .alpha.-(4-nitrophenyl)-, methyl ester, (.+-.)-
Alternate Name(s) Methyl 2-(4'-nitrophenyl)-3-(pyrrol-1''-yl)-propionate Methyl 2-(4-nitrophenyl)-3-(1H-pyrrol-1-yl)propanoate 2-(4-nitrophenyl)-3-(1-pyrrolyl)propanoic acid methyl ester Methyl 2-(4-nitrophenyl)-3-pyrrol-1-ylpropanoate Methyl 2-(4-nitrophenyl)-3-pyrrol-1-yl-propanoate
CAS Registry Number 111751-78-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14N2O4
InChI InChI=1S/C14H14N2O4/c1-20-14(17)13(10-15-8-2-3-9-15)11-4-6-12(7-5-11)16(18)19/h2-9,13H,10H2,1H3
InChIKey FXPYLSUYWQHKRI-UHFFFAOYSA-N
Molecular Weight 274.276 g/mol
SMILES c1(N(=O)=O)ccc(C(C(=O)OC)C[n]2cccc2)cc1
SPLASH splash10-001i-9000000000-73adc187624ae85fa56f
Source of Spectrum H-69-2055-0
Wiley ID 1277943