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(4E)-2-(1,3-benzothiazol-2-yl)-4-{[(2-phenylethyl)amino]methylene}-5-propyl-2,4-dihydro-3H-pyrazol-3-one
SpectraBase Compound ID F8VJmK6Op0g
InChI InChI=1S/C22H22N4OS/c1-2-8-18-17(15-23-14-13-16-9-4-3-5-10-16)21(27)26(25-18)22-24-19-11-6-7-12-20(19)28-22/h3-7,9-12,15,23H,2,8,13-14H2,1H3/b17-15+
InChIKey MJZWNMLAUXDQQS-BMRADRMJSA-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 EXdN65Afosk
Name (4E)-2-(1,3-benzothiazol-2-yl)-4-{[(2-phenylethyl)amino]methylene}-5-propyl-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/C22H22N4OS/c1-2-8-18-17(15-23-14-13-16-9-4-3-5-10-16)21(27)26(25-18)22-24-19-11-6-7-12-20(19)28-22/h3-7,9-12,15,23H,2,8,13-14H2,1H3/b17-15+
InChIKey MJZWNMLAUXDQQS-BMRADRMJSA-N
NMR Offset 17.1563
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_6906
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent CDCl3
Source File Reference VendorID: 124511; Labnumber: VOR11-9172; VK_ID: VK-006910
Synonyms 2-(1,3-benzothiazol-2-yl)-4-{[(2-phenylethyl)amino]methylene}-5-propyl-2,4-dihydro-3H-pyrazol-3-one
Temperature 308 °C