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2-[(4-benzyl-1-piperidinyl)carbonyl]-5-(3,4-dimethylphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
SpectraBase Compound ID CZX63Dna2QK
InChI InChI=1S/C28H27F3N4O/c1-18-8-9-22(14-19(18)2)23-16-25(28(29,30)31)35-26(32-23)17-24(33-35)27(36)34-12-10-21(11-13-34)15-20-6-4-3-5-7-20/h3-9,14,16-17,21H,10-13,15H2,1-2H3
InChIKey LJKNBNFJLDNKTN-UHFFFAOYSA-N
Mol Weight 492.55 g/mol
Molecular Formula C28H27F3N4O
Exact Mass 492.213696 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9JsQZJOuuO2
Name 2-[(4-benzyl-1-piperidinyl)carbonyl]-5-(3,4-dimethylphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 492.213695993 u
Formula C28H27F3N4O
InChI InChI=1S/C28H27F3N4O/c1-18-8-9-22(14-19(18)2)23-16-25(28(29,30)31)35-26(32-23)17-24(33-35)27(36)34-12-10-21(11-13-34)15-20-6-4-3-5-7-20/h3-9,14,16-17,21H,10-13,15H2,1-2H3
InChIKey LJKNBNFJLDNKTN-UHFFFAOYSA-N
Molecular Weight 492.546 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_3529
Solvent DMSO-d6
Source Vendor ID: NMR/12289698