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(4Z)-4-({[2-(1H-indol-3-yl)ethyl]amino}methylene)-5-methyl-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
SpectraBase Compound ID DHIXbzgwgRs
InChI InChI=1S/C21H19N5O3/c1-14-19(13-22-11-10-15-12-23-20-5-3-2-4-18(15)20)21(27)25(24-14)16-6-8-17(9-7-16)26(28)29/h2-9,12-13,22-23H,10-11H2,1H3/b19-13-
InChIKey DRDCWIPPPVKSGW-UYRXBGFRSA-N
Mol Weight 389.42 g/mol
Molecular Formula C21H19N5O3
Exact Mass 389.148789 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6T9giBvJxJk
Name (4Z)-4-({[2-(1H-indol-3-yl)ethyl]amino}methylene)-5-methyl-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
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/C21H19N5O3/c1-14-19(13-22-11-10-15-12-23-20-5-3-2-4-18(15)20)21(27)25(24-14)16-6-8-17(9-7-16)26(28)29/h2-9,12-13,22-23H,10-11H2,1H3/b19-13-
InChIKey DRDCWIPPPVKSGW-UYRXBGFRSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_16278
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/8091286; UBI_ID: UBI-016281
Synonyms 4-({[2-(1H-indol-3-yl)ethyl]amino}methylene)-5-methyl-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
Temperature 308 °C