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pyrrolo[3,4-c]pyrazol-6(1H)-one, 3-(4-bromophenyl)-4-(2-fluorophenyl)-4,5-dihydro-5-(4-methylphenyl)-
SpectraBase Compound ID 2DtWl9dWeHI
InChI InChI=1S/C24H17BrFN3O/c1-14-6-12-17(13-7-14)29-23(18-4-2-3-5-19(18)26)20-21(27-28-22(20)24(29)30)15-8-10-16(25)11-9-15/h2-13,23H,1H3,(H,27,28)
InChIKey XWHNCELRFXRXOW-UHFFFAOYSA-N
Mol Weight 462.32 g/mol
Molecular Formula C24H17BrFN3O
Exact Mass 461.053903 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IswabWJedfK
Name pyrrolo[3,4-c]pyrazol-6(1H)-one, 3-(4-bromophenyl)-4-(2-fluorophenyl)-4,5-dihydro-5-(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 461.053903341 u
Formula C24H17BrFN3O
InChI InChI=1S/C24H17BrFN3O/c1-14-6-12-17(13-7-14)29-23(18-4-2-3-5-19(18)26)20-21(27-28-22(20)24(29)30)15-8-10-16(25)11-9-15/h2-13,23H,1H3,(H,27,28)
InChIKey XWHNCELRFXRXOW-UHFFFAOYSA-N
Molecular Weight 462.322 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_7385
Solvent DMSO-d6
Source Vendor ID: NMR/13308159