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N-(2-fluorophenyl)-2-{[1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl}acetamide
SpectraBase Compound ID 3eOTaBQZl6l
InChI InChI=1S/C20H16FN5OS/c1-13-6-8-14(9-7-13)26-19-15(10-24-26)20(23-12-22-19)28-11-18(27)25-17-5-3-2-4-16(17)21/h2-10,12H,11H2,1H3,(H,25,27)
InChIKey CKQKLHZQSMOTJX-UHFFFAOYSA-N
Mol Weight 393.44 g/mol
Molecular Formula C20H16FN5OS
Exact Mass 393.105959 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AvWrUpCxDk9
Name N-(2-fluorophenyl)-2-{[1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl}acetamide
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/C20H16FN5OS/c1-13-6-8-14(9-7-13)26-19-15(10-24-26)20(23-12-22-19)28-11-18(27)25-17-5-3-2-4-16(17)21/h2-10,12H,11H2,1H3,(H,25,27)
InChIKey CKQKLHZQSMOTJX-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_9913
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: D62185; Labnumber: UDSG-05851; SBI_ID: SBI-009916
Temperature 315 °C