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Methyl-(E)-2-cyano-3-(5-iodo-4-methyl-3-octyl-2-pyrrolyl)-propenoate

View entire compound with spectra: 1 NMR

Methyl-(E)-2-cyano-3-(5-iodo-4-methyl-3-octyl-2-pyrrolyl)-propenoate
SpectraBase Compound ID HzFaOoSo6pO
InChI InChI=1S/C18H25IN2O2/c1-4-5-6-7-8-9-10-15-13(2)17(19)21-16(15)11-14(12-20)18(22)23-3/h11,21H,4-10H2,1-3H3/b14-11-
InChIKey UIMQKDJCCRCNFZ-KAMYIIQDSA-N
Mol Weight 428.31 g/mol
Molecular Formula C18H25IN2O2
Exact Mass 428.096073 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AXRx9D68LlP
Name Methyl-(E)-2-cyano-3-(5-iodo-4-methyl-3-octyl-2-pyrrolyl)-propenoate
CAS Registry Number 113998-92-8
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C18H25IN2O2
InChI InChI=1S/C18H25IN2O2/c1-4-5-6-7-8-9-10-15-13(2)17(19)21-16(15)11-14(12-20)18(22)23-3/h11,21H,4-10H2,1-3H3/b14-11-
InChIKey UIMQKDJCCRCNFZ-KAMYIIQDSA-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