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1-{[7-(difluoromethyl)-5-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidin-3-yl]carbonyl}-6-fluoro-2-methyl-1,2,3,4-tetrahydroquinoline
SpectraBase Compound ID KKLPFt7gqzd
InChI InChI=1S/C25H21F3N4O2/c1-14-3-4-16-11-17(26)7-10-21(16)31(14)25(33)19-13-29-32-22(23(27)28)12-20(30-24(19)32)15-5-8-18(34-2)9-6-15/h5-14,23H,3-4H2,1-2H3
InChIKey QSYPATIWUJPGFH-UHFFFAOYSA-N
Mol Weight 466.46 g/mol
Molecular Formula C25H21F3N4O2
Exact Mass 466.16166 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1R4KIdmf1Cq
Name 1-{[7-(difluoromethyl)-5-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidin-3-yl]carbonyl}-6-fluoro-2-methyl-1,2,3,4-tetrahydroquinoline
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/C25H21F3N4O2/c1-14-3-4-16-11-17(26)7-10-21(16)31(14)25(33)19-13-29-32-22(23(27)28)12-20(30-24(19)32)15-5-8-18(34-2)9-6-15/h5-14,23H,3-4H2,1-2H3
InChIKey QSYPATIWUJPGFH-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_13883
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/9317837; UBI_ID: UBI-013886
Synonyms 4-{7-(difluoromethyl)-3-[(6-fluoro-2-methyl-3,4-dihydro-1(2H)-quinolinyl)carbonyl]pyrazolo[1,5-a]pyrimidin-5-yl}phenyl methyl ether
Temperature 308 °C