For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

1H-pyrazole-3-acetic acid, 1-(2-benzothiazolyl)-4,5-dihydro-5-oxo-4-[1-[[3-(trifluoromethoxy)phenyl]amino]ethylidene]-, methyl ester, (4Z)-

View entire compound with spectra: 1 NMR

1H-pyrazole-3-acetic acid, 1-(2-benzothiazolyl)-4,5-dihydro-5-oxo-4-[1-[[3-(trifluoromethoxy)phenyl]amino]ethylidene]-, methyl ester, (4Z)-
SpectraBase Compound ID Cm34ItysFqW
InChI InChI=1S/C22H17F3N4O4S/c1-12(26-13-6-5-7-14(10-13)33-22(23,24)25)19-16(11-18(30)32-2)28-29(20(19)31)21-27-15-8-3-4-9-17(15)34-21/h3-10,26H,11H2,1-2H3/b19-12-
InChIKey XPSNJAJFZZXWKB-UNOMPAQXSA-N
Mol Weight 490.46 g/mol
Molecular Formula C22H17F3N4O4S
Exact Mass 490.092261 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID L0kw22L75aA
Name 1H-pyrazole-3-acetic acid, 1-(2-benzothiazolyl)-4,5-dihydro-5-oxo-4-[1-[[3-(trifluoromethoxy)phenyl]amino]ethylidene]-, methyl ester, (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/C22H17F3N4O4S/c1-12(26-13-6-5-7-14(10-13)33-22(23,24)25)19-16(11-18(30)32-2)28-29(20(19)31)21-27-15-8-3-4-9-17(15)34-21/h3-10,26H,11H2,1-2H3/b19-12-
InChIKey XPSNJAJFZZXWKB-UNOMPAQXSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_956
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: F06868; Labnumber: VGU-78033
Temperature 308 °C