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3H-pyrazol-3-one, 2-(2-benzothiazolyl)-2,4-dihydro-4-[1-[(3-hydroxypropyl)amino]ethylidene]-5-propyl-, (4Z)-
SpectraBase Compound ID LlmmtNirnEB
InChI InChI=1S/C18H22N4O2S/c1-3-7-14-16(12(2)19-10-6-11-23)17(24)22(21-14)18-20-13-8-4-5-9-15(13)25-18/h4-5,8-9,19,23H,3,6-7,10-11H2,1-2H3/b16-12-
InChIKey WLWYPXROHBCWMH-VBKFSLOCSA-N
Mol Weight 358.46 g/mol
Molecular Formula C18H22N4O2S
Exact Mass 358.146347 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FwvAjYzeQeb
Name 3H-pyrazol-3-one, 2-(2-benzothiazolyl)-2,4-dihydro-4-[1-[(3-hydroxypropyl)amino]ethylidene]-5-propyl-, (4Z)-
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/C18H22N4O2S/c1-3-7-14-16(12(2)19-10-6-11-23)17(24)22(21-14)18-20-13-8-4-5-9-15(13)25-18/h4-5,8-9,19,23H,3,6-7,10-11H2,1-2H3/b16-12-
InChIKey WLWYPXROHBCWMH-VBKFSLOCSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_880
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: F06789; Labnumber: VGU-76963