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5-(1,3-benzodioxol-5-yl)-N-methyl-7-(trifluoromethyl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-
SpectraBase Compound ID EIWzbYjOP5V
InChI InChI=1S/C23H25F3N6O3/c1-12-15(13(2)31(4)28-12)10-30(3)22(33)17-9-21-27-16(8-20(23(24,25)26)32(21)29-17)14-5-6-18-19(7-14)35-11-34-18/h5-7,9,16,20,27H,8,10-11H2,1-4H3
InChIKey BIBYTGKUHJBNRO-UHFFFAOYSA-N
Mol Weight 490.49 g/mol
Molecular Formula C23H25F3N6O3
Exact Mass 490.194023 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AlHjPDAxerF
Name 5-(1,3-benzodioxol-5-yl)-N-methyl-7-(trifluoromethyl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 490.194023175 u
Formula C23H25F3N6O3
InChI InChI=1S/C23H25F3N6O3/c1-12-15(13(2)31(4)28-12)10-30(3)22(33)17-9-21-27-16(8-20(23(24,25)26)32(21)29-17)14-5-6-18-19(7-14)35-11-34-18/h5-7,9,16,20,27H,8,10-11H2,1-4H3
InChIKey BIBYTGKUHJBNRO-UHFFFAOYSA-N
Molecular Weight 490.487 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_3659
Solvent DMSO-d6
Source Vendor ID: NMR/12289982