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(2E)-N-benzyl-2-cyano-3-{1-[2-(4-fluoroanilino)-2-oxoethyl]-1H-indol-3-yl}-2-propenamide
SpectraBase Compound ID A2Grm6KlOmu
InChI InChI=1S/C27H21FN4O2/c28-22-10-12-23(13-11-22)31-26(33)18-32-17-21(24-8-4-5-9-25(24)32)14-20(15-29)27(34)30-16-19-6-2-1-3-7-19/h1-14,17H,16,18H2,(H,30,34)(H,31,33)/b20-14+
InChIKey ZHXMOPWLEBBMJP-XSFVSMFZSA-N
Mol Weight 452.49 g/mol
Molecular Formula C27H21FN4O2
Exact Mass 452.164854 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 16MDdO90ef8
Name (2E)-N-benzyl-2-cyano-3-{1-[2-(4-fluoroanilino)-2-oxoethyl]-1H-indol-3-yl}-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/C27H21FN4O2/c28-22-10-12-23(13-11-22)31-26(33)18-32-17-21(24-8-4-5-9-25(24)32)14-20(15-29)27(34)30-16-19-6-2-1-3-7-19/h1-14,17H,16,18H2,(H,30,34)(H,31,33)/b20-14+
InChIKey ZHXMOPWLEBBMJP-XSFVSMFZSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_21174
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: UZI/9675264; UBI_ID: UBI-021178
Synonyms N-benzyl-2-cyano-3-{1-[2-(4-fluoroanilino)-2-oxoethyl]-1H-indol-3-yl}-2-propenamide
Temperature 318 °C