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6-(1-adamantyl)-4-(difluoromethyl)-3-methyl-1-phenyl-1H-pyrazolo[3,4-b]pyridine
SpectraBase Compound ID 5QJGidnCrNE
InChI InChI=1S/C24H25F2N3/c1-14-21-19(22(25)26)10-20(24-11-15-7-16(12-24)9-17(8-15)13-24)27-23(21)29(28-14)18-5-3-2-4-6-18/h2-6,10,15-17,22H,7-9,11-13H2,1H3/t15-,16+,17-,24-
InChIKey TZNMVRHYXMKIOC-ONHXBKDTSA-N
Mol Weight 393.48 g/mol
Molecular Formula C24H25F2N3
Exact Mass 393.201654 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 88CmxU3jQVS
Name 6-(1-adamantyl)-4-(difluoromethyl)-3-methyl-1-phenyl-1H-pyrazolo[3,4-b]pyridine
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C24H25F2N3/c1-14-21-19(22(25)26)10-20(24-11-15-7-16(12-24)9-17(8-15)13-24)27-23(21)29(28-14)18-5-3-2-4-6-18/h2-6,10,15-17,22H,7-9,11-13H2,1H3/t15-,16+,17-,24-
InChIKey TZNMVRHYXMKIOC-ONHXBKDTSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_30721
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: 1724548; SBI_ID: SBI-030725
Temperature 318 °C