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3-cyclopropyl-6-(5-ethyl-2-thienyl)-1-phenyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridine
SpectraBase Compound ID 6Vzcq18W9L1
InChI InChI=1S/C22H18F3N3S/c1-2-15-10-11-18(29-15)17-12-16(22(23,24)25)19-20(13-8-9-13)27-28(21(19)26-17)14-6-4-3-5-7-14/h3-7,10-13H,2,8-9H2,1H3
InChIKey BOCPBPXAUUAVFS-UHFFFAOYSA-N
Mol Weight 413.46 g/mol
Molecular Formula C22H18F3N3S
Exact Mass 413.117353 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6bBpG8Rhr1i
Name 3-cyclopropyl-6-(5-ethyl-2-thienyl)-1-phenyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridine
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/C22H18F3N3S/c1-2-15-10-11-18(29-15)17-12-16(22(23,24)25)19-20(13-8-9-13)27-28(21(19)26-17)14-6-4-3-5-7-14/h3-7,10-13H,2,8-9H2,1H3
InChIKey BOCPBPXAUUAVFS-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_31004
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: 1728228; SBI_ID: SBI-031008
Temperature 306 °C