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(2E)-2-cyano-3-[2,5-dimethyl-1-(2-methyl-4-nitrophenyl)-1H-pyrrol-3-yl]-N-(2-fluorophenyl)-2-propenamide
SpectraBase Compound ID p06JgQzI1S
InChI InChI=1S/C23H19FN4O3/c1-14-10-19(28(30)31)8-9-22(14)27-15(2)11-17(16(27)3)12-18(13-25)23(29)26-21-7-5-4-6-20(21)24/h4-12H,1-3H3,(H,26,29)/b18-12+
InChIKey IDAXEPRCEPPTRO-LDADJPATSA-N
Mol Weight 418.43 g/mol
Molecular Formula C23H19FN4O3
Exact Mass 418.144119 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9ckqxBBVwUM
Name (2E)-2-cyano-3-[2,5-dimethyl-1-(2-methyl-4-nitrophenyl)-1H-pyrrol-3-yl]-N-(2-fluorophenyl)-2-propenamide
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C23H19FN4O3/c1-14-10-19(28(30)31)8-9-22(14)27-15(2)11-17(16(27)3)12-18(13-25)23(29)26-21-7-5-4-6-20(21)24/h4-12H,1-3H3,(H,26,29)/b18-12+
InChIKey IDAXEPRCEPPTRO-LDADJPATSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_15730
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: C75114; Labnumber: SPDEM-2221; SBI_ID: SBI-015733
Synonyms 2-cyano-3-[2,5-dimethyl-1-(2-methyl-4-nitrophenyl)-1H-pyrrol-3-yl]-N-(2-fluorophenyl)-2-propenamide
Temperature 318 °C