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METHYL-E-3-(4-ETHYL-3-METHYL-PYRROL-5-YL)-2-CYANOPROPENOATE
SpectraBase Compound ID DV0n70kTpFo
InChI InChI=1S/C12H14N2O2/c1-4-10-8(2)7-14-11(10)5-9(6-13)12(15)16-3/h5,7,14H,4H2,1-3H3/b9-5+
InChIKey LKMNYFVMPGPMQU-WEVVVXLNSA-N
Mol Weight 218.26 g/mol
Molecular Formula C12H14N2O2
Exact Mass 218.105528 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3MWcLfWPi0M
Name METHYL-(E)-2-CYANO-3-(3-ETHYL-4-METHYL-2-PYRROLYL)-PROPENOATE
CAS Registry Number 113998-84-8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H14N2O2
InChI InChI=1S/C12H14N2O2/c1-4-10-8(2)7-14-11(10)5-9(6-13)12(15)16-3/h5,7,14H,4H2,1-3H3/b9-5+
InChIKey LKMNYFVMPGPMQU-WEVVVXLNSA-N
Literature Reference Author J.B.PAINE,D.DOLPHIN
Literature Reference Citation J.ORG.CHEM.,53,2787(1988)
Literature Reference DOI 10.1021/jo00247a024
Molecular Weight 218.255 g/mol
Solvent CDCl3
Source File Reference UNIW20832