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1-{[7-(difluoromethyl)-5-(4-methylphenyl)pyrazolo[1,5-a]pyrimidin-3-yl]carbonyl}-6-fluoro-2-methyl-1,2,3,4-tetrahydroquinoline
SpectraBase Compound ID AarSxQToI78
InChI InChI=1S/C25H21F3N4O/c1-14-3-6-16(7-4-14)20-12-22(23(27)28)32-24(30-20)19(13-29-32)25(33)31-15(2)5-8-17-11-18(26)9-10-21(17)31/h3-4,6-7,9-13,15,23H,5,8H2,1-2H3
InChIKey CBFUZYOIYLUZMK-UHFFFAOYSA-N
Mol Weight 450.47 g/mol
Molecular Formula C25H21F3N4O
Exact Mass 450.166746 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3dPGppPI6jB
Name 1-{[7-(difluoromethyl)-5-(4-methylphenyl)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/C25H21F3N4O/c1-14-3-6-16(7-4-14)20-12-22(23(27)28)32-24(30-20)19(13-29-32)25(33)31-15(2)5-8-17-11-18(26)9-10-21(17)31/h3-4,6-7,9-13,15,23H,5,8H2,1-2H3
InChIKey CBFUZYOIYLUZMK-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_3749
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: 9315229; UBI_ID: UBI-003750
Temperature 313 °C