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1-(1,3-benzothiazol-2-yl)-4-[[1-(1,3-benzothiazol-2-yl)-5-hydroxy-3-methyl-1H-pyrazol-4-yl](4-fluorophenyl)methyl]-3-methyl-1H-pyrazol-5-ol

View entire compound with spectra: 1 NMR

1-(1,3-benzothiazol-2-yl)-4-[[1-(1,3-benzothiazol-2-yl)-5-hydroxy-3-methyl-1H-pyrazol-4-yl](4-fluorophenyl)methyl]-3-methyl-1H-pyrazol-5-ol
SpectraBase Compound ID K94iQ1Xjjss
InChI InChI=1S/C29H21FN6O2S2/c1-15-23(26(37)35(33-15)28-31-19-7-3-5-9-21(19)39-28)25(17-11-13-18(30)14-12-17)24-16(2)34-36(27(24)38)29-32-20-8-4-6-10-22(20)40-29/h3-14,25,37-38H,1-2H3
InChIKey ZMCNXXWJHSIPOE-UHFFFAOYSA-N
Mol Weight 568.65 g/mol
Molecular Formula C29H21FN6O2S2
Exact Mass 568.115144 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AyKu7WuVjyP
Name 1-(1,3-benzothiazol-2-yl)-4-[[1-(1,3-benzothiazol-2-yl)-5-hydroxy-3-methyl-1H-pyrazol-4-yl](4-fluorophenyl)methyl]-3-methyl-1H-pyrazol-5-ol
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/C29H21FN6O2S2/c1-15-23(26(37)35(33-15)28-31-19-7-3-5-9-21(19)39-28)25(17-11-13-18(30)14-12-17)24-16(2)34-36(27(24)38)29-32-20-8-4-6-10-22(20)40-29/h3-14,25,37-38H,1-2H3
InChIKey ZMCNXXWJHSIPOE-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_18162
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: UZI/8163976; Labnumber: TC-0000452; UZI_ID: UZI-018169
Temperature 318 °C