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6-(5-chloro-2-thienyl)-1,3-dimethyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridine
SpectraBase Compound ID 4WG7qXzmcFO
InChI InChI=1S/C13H9ClF3N3S/c1-6-11-7(13(15,16)17)5-8(9-3-4-10(14)21-9)18-12(11)20(2)19-6/h3-5H,1-2H3
InChIKey UKMAEKWJRWVCOI-UHFFFAOYSA-N
Mol Weight 331.74 g/mol
Molecular Formula C13H9ClF3N3S
Exact Mass 331.015781 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JqNYCXG4v4z
Name 6-(5-chloro-2-thienyl)-1,3-dimethyl-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/C13H9ClF3N3S/c1-6-11-7(13(15,16)17)5-8(9-3-4-10(14)21-9)18-12(11)20(2)19-6/h3-5H,1-2H3
InChIKey UKMAEKWJRWVCOI-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_30838
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: 1727897; SBI_ID: SBI-030842
Temperature 318 °C