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Methyl-(E)-2-cyano-3-(3-ethyl-5-iodo-4-methyl-2-pyrrolyl)-propenoate
SpectraBase Compound ID L1iectek4tW
InChI InChI=1S/C12H13IN2O2/c1-4-9-7(2)11(13)15-10(9)5-8(6-14)12(16)17-3/h5,15H,4H2,1-3H3/b8-5-
InChIKey BTSDYSGADCYDKC-YVMONPNESA-N
Mol Weight 344.15 g/mol
Molecular Formula C12H13IN2O2
Exact Mass 344.002173 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5gikqljdxJs
Name Methyl-(E)-2-cyano-3-(3-ethyl-5-iodo-4-methyl-2-pyrrolyl)-propenoate
CAS Registry Number 113998-80-4
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H13IN2O2
InChI InChI=1S/C12H13IN2O2/c1-4-9-7(2)11(13)15-10(9)5-8(6-14)12(16)17-3/h5,15H,4H2,1-3H3/b8-5-
InChIKey BTSDYSGADCYDKC-YVMONPNESA-N
Instrument Name SF = 400 MHz
Literature Reference J. Org. Chem. 53, 2787 (1988).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3