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3H-pyrazol-3-one, 2-(4-chlorophenyl)-4-[[4-(diethylamino)phenyl]methylene]-2,4-dihydro-5-methyl-, (4E)-
SpectraBase Compound ID I8ooDHnylKA
InChI InChI=1S/C21H22ClN3O/c1-4-24(5-2)18-10-6-16(7-11-18)14-20-15(3)23-25(21(20)26)19-12-8-17(22)9-13-19/h6-14H,4-5H2,1-3H3/b20-14+
InChIKey NWNOKVOSQUMLCT-XSFVSMFZSA-N
Mol Weight 367.88 g/mol
Molecular Formula C21H22ClN3O
Exact Mass 367.14514 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5wl49vBGvuh
Name 3H-pyrazol-3-one, 2-(4-chlorophenyl)-4-[[4-(diethylamino)phenyl]methylene]-2,4-dihydro-5-methyl-, (4E)-
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/C21H22ClN3O/c1-4-24(5-2)18-10-6-16(7-11-18)14-20-15(3)23-25(21(20)26)19-12-8-17(22)9-13-19/h6-14H,4-5H2,1-3H3/b20-14+
InChIKey NWNOKVOSQUMLCT-XSFVSMFZSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_8516_159
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: AG-205/5057506; Labnumber: MAR-657; IOH_ID: IOH-007160