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3H-pyrazol-3-one, 2-(2-benzothiazolyl)-4-[[4-(dimethylamino)phenyl]methylene]-2,4-dihydro-5-propyl-, (4E)-
SpectraBase Compound ID BiJSfVLGqGC
InChI InChI=1S/C22H22N4OS/c1-4-7-18-17(14-15-10-12-16(13-11-15)25(2)3)21(27)26(24-18)22-23-19-8-5-6-9-20(19)28-22/h5-6,8-14H,4,7H2,1-3H3/b17-14+
InChIKey LQTLTCPSJZGSBM-SAPNQHFASA-N
Mol Weight 390.51 g/mol
Molecular Formula C22H22N4OS
Exact Mass 390.151433 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID qHREhZRNoQ
Name 3H-pyrazol-3-one, 2-(2-benzothiazolyl)-4-[[4-(dimethylamino)phenyl]methylene]-2,4-dihydro-5-propyl-, (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/C22H22N4OS/c1-4-7-18-17(14-15-10-12-16(13-11-15)25(2)3)21(27)26(24-18)22-23-19-8-5-6-9-20(19)28-22/h5-6,8-14H,4,7H2,1-3H3/b17-14+
InChIKey LQTLTCPSJZGSBM-SAPNQHFASA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_157
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: NMR/11249826