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benzoic acid, 2-[[3-[2-(3-fluorophenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl]-1-oxopropyl]amino]-, ethyl ester
SpectraBase Compound ID AT7vzlEonh9
InChI InChI=1S/C26H25FN4O3/c1-4-34-26(33)21-10-5-6-11-22(21)29-25(32)13-12-20-16(2)28-24-15-23(30-31(24)17(20)3)18-8-7-9-19(27)14-18/h5-11,14-15H,4,12-13H2,1-3H3,(H,29,32)
InChIKey CINOMTBVYUUETI-UHFFFAOYSA-N
Mol Weight 460.51 g/mol
Molecular Formula C26H25FN4O3
Exact Mass 460.191069 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8JojFaIXAjp
Name benzoic acid, 2-[[3-[2-(3-fluorophenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl]-1-oxopropyl]amino]-, ethyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 460.191068841 u
Formula C26H25FN4O3
InChI InChI=1S/C26H25FN4O3/c1-4-34-26(33)21-10-5-6-11-22(21)29-25(32)13-12-20-16(2)28-24-15-23(30-31(24)17(20)3)18-8-7-9-19(27)14-18/h5-11,14-15H,4,12-13H2,1-3H3,(H,29,32)
InChIKey CINOMTBVYUUETI-UHFFFAOYSA-N
Molecular Weight 460.509 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_2951
Solvent DMSO-d6
Source Vendor ID: NMR/12689643