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pyrrolo[3,4-c]pyrazol-6(1H)-one, 4-(1,3-benzodioxol-5-yl)-5-(4-fluorophenyl)-4,5-dihydro-3-(4-methylphenyl)-
SpectraBase Compound ID 5pXuZAPKwm5
InChI InChI=1S/C25H18FN3O3/c1-14-2-4-15(5-3-14)22-21-23(28-27-22)25(30)29(18-9-7-17(26)8-10-18)24(21)16-6-11-19-20(12-16)32-13-31-19/h2-12,24H,13H2,1H3,(H,27,28)
InChIKey WDDRYSRFSYUBQA-UHFFFAOYSA-N
Mol Weight 427.44 g/mol
Molecular Formula C25H18FN3O3
Exact Mass 427.13322 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EUAFY11LwrB
Name pyrrolo[3,4-c]pyrazol-6(1H)-one, 4-(1,3-benzodioxol-5-yl)-5-(4-fluorophenyl)-4,5-dihydro-3-(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 427.133219612 u
Formula C25H18FN3O3
InChI InChI=1S/C25H18FN3O3/c1-14-2-4-15(5-3-14)22-21-23(28-27-22)25(30)29(18-9-7-17(26)8-10-18)24(21)16-6-11-19-20(12-16)32-13-31-19/h2-12,24H,13H2,1H3,(H,27,28)
InChIKey WDDRYSRFSYUBQA-UHFFFAOYSA-N
Molecular Weight 427.435 g/mol
NMR Offset 16.0087
NMR Spectrometer Frequency 500.133
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_4459
Solvent DMSO-d6
Source Vendor ID: ZI/9041670; Lab Info: GEI; Lab Number: GEI-G005947