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pyrazolo[1,5-a]pyrimidine-2-carboxamide, 3-chloro-N-(2,3-dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)-5-(4-methoxyphenyl)-7-
SpectraBase Compound ID 5mgc2L6IJfb
InChI InChI=1S/C26H20ClF3N6O3/c1-14-21(25(38)36(34(14)2)16-7-5-4-6-8-16)32-24(37)22-20(27)23-31-18(15-9-11-17(39-3)12-10-15)13-19(26(28,29)30)35(23)33-22/h4-13H,1-3H3,(H,32,37)
InChIKey URFHXSFNFUVJSO-UHFFFAOYSA-N
Mol Weight 556.93 g/mol
Molecular Formula C26H20ClF3N6O3
Exact Mass 556.123751 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3xwAW7Yr8y
Name pyrazolo[1,5-a]pyrimidine-2-carboxamide, 3-chloro-N-(2,3-dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)-5-(4-methoxyphenyl)-7-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 556.123750714 u
Formula C26H20ClF3N6O3
InChI InChI=1S/C26H20ClF3N6O3/c1-14-21(25(38)36(34(14)2)16-7-5-4-6-8-16)32-24(37)22-20(27)23-31-18(15-9-11-17(39-3)12-10-15)13-19(26(28,29)30)35(23)33-22/h4-13H,1-3H3,(H,32,37)
InChIKey URFHXSFNFUVJSO-UHFFFAOYSA-N
Molecular Weight 556.933 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_3058
Solvent DMSO-d6
Source Vendor ID: NMR/9258428; Lab Info: *1058616*; Lab Number: BAS 1058616
Temperature 23.85 °C