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4H-pyrazolo[3,4-d]pyrimidin-4-one, 5-(3-chloro-4-fluorophenyl)-6-(2-furanyl)-1,5-dihydro-1-(4-methylphenyl)-
SpectraBase Compound ID B7WkW5qQBAi
InChI InChI=1S/C22H14ClFN4O2/c1-13-4-6-14(7-5-13)28-20-16(12-25-28)22(29)27(15-8-9-18(24)17(23)11-15)21(26-20)19-3-2-10-30-19/h2-12H,1H3
InChIKey IMBZWBWZARFLGY-UHFFFAOYSA-N
Mol Weight 420.83 g/mol
Molecular Formula C22H14ClFN4O2
Exact Mass 420.078932 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AOncdZ00wwc
Name 4H-pyrazolo[3,4-d]pyrimidin-4-one, 5-(3-chloro-4-fluorophenyl)-6-(2-furanyl)-1,5-dihydro-1-(4-methylphenyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 420.078931568 u
Formula C22H14ClFN4O2
InChI InChI=1S/C22H14ClFN4O2/c1-13-4-6-14(7-5-13)28-20-16(12-25-28)22(29)27(15-8-9-18(24)17(23)11-15)21(26-20)19-3-2-10-30-19/h2-12H,1H3
InChIKey IMBZWBWZARFLGY-UHFFFAOYSA-N
Molecular Weight 420.831 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_2306
Solvent DMSO-d6
Source Vendor ID: NMR/13268582