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1-butyl-6-(5-chloro-2-thienyl)-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridine
SpectraBase Compound ID ItKG3Uu62S7
InChI InChI=1S/C16H15ClF3N3S/c1-3-4-7-23-15-14(9(2)22-23)10(16(18,19)20)8-11(21-15)12-5-6-13(17)24-12/h5-6,8H,3-4,7H2,1-2H3
InChIKey GHKCLRUYLSEZJY-UHFFFAOYSA-N
Mol Weight 373.83 g/mol
Molecular Formula C16H15ClF3N3S
Exact Mass 373.062731 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID A1vWu3YuTed
Name 1-butyl-6-(5-chloro-2-thienyl)-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridine
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C16H15ClF3N3S/c1-3-4-7-23-15-14(9(2)22-23)10(16(18,19)20)8-11(21-15)12-5-6-13(17)24-12/h5-6,8H,3-4,7H2,1-2H3
InChIKey GHKCLRUYLSEZJY-UHFFFAOYSA-N
NMR Offset 17.9104
NMR Spectrometer Frequency 500.077
Observed nucleus 1H
Origin 1H_SBI_36227_32418
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: 1847692; SBI_ID: SBI-032422
Temperature 303 °C