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3H-pyrazol-3-one, 1,2-dihydro-1,5-dimethyl-4-[[(E)-[5-nitro-2-(1-pyrrolidinyl)phenyl]methylidene]amino]-2-phenyl-
SpectraBase Compound ID KCEOW81eCmX
InChI InChI=1S/C22H23N5O3/c1-16-21(22(28)26(24(16)2)18-8-4-3-5-9-18)23-15-17-14-19(27(29)30)10-11-20(17)25-12-6-7-13-25/h3-5,8-11,14-15H,6-7,12-13H2,1-2H3/b23-15+
InChIKey BMODBGRIOSAUCJ-HZHRSRAPSA-N
Mol Weight 405.46 g/mol
Molecular Formula C22H23N5O3
Exact Mass 405.18009 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8DE6n5AgYmr
Name 3H-pyrazol-3-one, 1,2-dihydro-1,5-dimethyl-4-[[(E)-[5-nitro-2-(1-pyrrolidinyl)phenyl]methylidene]amino]-2-phenyl-
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/C22H23N5O3/c1-16-21(22(28)26(24(16)2)18-8-4-3-5-9-18)23-15-17-14-19(27(29)30)10-11-20(17)25-12-6-7-13-25/h3-5,8-11,14-15H,6-7,12-13H2,1-2H3/b23-15+
InChIKey BMODBGRIOSAUCJ-HZHRSRAPSA-N
NMR Offset 15.1248
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_8516_6202
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: ZI/6013466; Labnumber: LP-29/50; IOH_ID: IOH-013205
Temperature 313 °C