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6-(1-adamantyl)-1,3-dimethyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridine

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6-(1-adamantyl)-1,3-dimethyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridine
SpectraBase Compound ID AkBGnPH11dP
InChI InChI=1S/C19H22F3N3/c1-10-16-14(19(20,21)22)6-15(23-17(16)25(2)24-10)18-7-11-3-12(8-18)5-13(4-11)9-18/h6,11-13H,3-5,7-9H2,1-2H3/t11-,12+,13-,18-
InChIKey XFVGXKVQCKDHPZ-MCXHQAMOSA-N
Mol Weight 349.4 g/mol
Molecular Formula C19H22F3N3
Exact Mass 349.176582 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID C7BFMfEKrdH
Name 6-(1-adamantyl)-1,3-dimethyl-4-(trifluoromethyl)-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/C19H22F3N3/c1-10-16-14(19(20,21)22)6-15(23-17(16)25(2)24-10)18-7-11-3-12(8-18)5-13(4-11)9-18/h6,11-13H,3-5,7-9H2,1-2H3/t11-,12+,13-,18-
InChIKey XFVGXKVQCKDHPZ-MCXHQAMOSA-N
NMR Offset 17.9121
NMR Spectrometer Frequency 500.077
Observed nucleus 1H
Origin 1H_SBI_36227_30944
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: 1728119; SBI_ID: SBI-030948
Temperature 303 °C