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3-bromo-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-5-phenyl-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
SpectraBase Compound ID EA8g84BFf2v
InChI InChI=1S/C25H22BrF3N6O2/c1-14-20(24(37)35(33(14)2)16-11-7-4-8-12-16)31-23(36)21-19(26)22-30-17(15-9-5-3-6-10-15)13-18(25(27,28)29)34(22)32-21/h3-12,17-18,30H,13H2,1-2H3,(H,31,36)
InChIKey ODTMPMXOQIHZTE-UHFFFAOYSA-N
Mol Weight 575.39 g/mol
Molecular Formula C25H22BrF3N6O2
Exact Mass 574.093971 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IcFzQyMSZg
Name 3-bromo-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-5-phenyl-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
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/C25H22BrF3N6O2/c1-14-20(24(37)35(33(14)2)16-11-7-4-8-12-16)31-23(36)21-19(26)22-30-17(15-9-5-3-6-10-15)13-18(25(27,28)29)34(22)32-21/h3-12,17-18,30H,13H2,1-2H3,(H,31,36)
InChIKey ODTMPMXOQIHZTE-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_12003
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/9099866; UBI_ID: UBI-012006
Temperature 308 °C