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object
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_id
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Lhq1ctpMcUt
spectrumID
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Lhq1ctpMcUt
cost
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specType
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8388608
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dbLocation
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NY2X:47144:1
hasStructureAssignments
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properties
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analyticalTechnique
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1H NMR
analyticalTechniqueLongName
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1H Nuclear Magnetic Resonance (NMR) Spectrum
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6H-pyrazolo[3,4-b]pyridin-6-one, 1-(4,6-dimethyl-2-pyrimidinyl)-4-(4-fluorophenyl)-1,4,5,7-tetrahydro-3-phenyl-
SpectraBase Compound ID 3YUNCKvoOXf
InChI InChI=1S/C24H20FN5O/c1-14-12-15(2)27-24(26-14)30-23-21(22(29-30)17-6-4-3-5-7-17)19(13-20(31)28-23)16-8-10-18(25)11-9-16/h3-12,19H,13H2,1-2H3,(H,28,31)
InChIKey DFMYLTAWPKKUJY-UHFFFAOYSA-N
Mol Weight 413.46 g/mol
Molecular Formula C24H20FN5O
Exact Mass 413.165188 g/mol
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1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Lhq1ctpMcUt
Name 6H-pyrazolo[3,4-b]pyridin-6-one, 1-(4,6-dimethyl-2-pyrimidinyl)-4-(4-fluorophenyl)-1,4,5,7-tetrahydro-3-phenyl-
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C24H20FN5O/c1-14-12-15(2)27-24(26-14)30-23-21(22(29-30)17-6-4-3-5-7-17)19(13-20(31)28-23)16-8-10-18(25)11-9-16/h3-12,19H,13H2,1-2H3,(H,28,31)
InChIKey DFMYLTAWPKKUJY-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_3273
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: F17416; Labnumber: MAVAS-S1202-4690
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