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phenol, 4-[1-[(3-chlorophenyl)methyl]-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-6-yl]-
SpectraBase Compound ID HAX44iTsqBd
InChI InChI=1S/C21H15ClF3N3O/c1-12-19-17(21(23,24)25)10-18(14-5-7-16(29)8-6-14)26-20(19)28(27-12)11-13-3-2-4-15(22)9-13/h2-10,29H,11H2,1H3
InChIKey NAOAKEYFANBGLI-UHFFFAOYSA-N
Mol Weight 417.82 g/mol
Molecular Formula C21H15ClF3N3O
Exact Mass 417.085574 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Is2C0CIJ5MZ
Name phenol, 4-[1-[(3-chlorophenyl)methyl]-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-6-yl]-
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/C21H15ClF3N3O/c1-12-19-17(21(23,24)25)10-18(14-5-7-16(29)8-6-14)26-20(19)28(27-12)11-13-3-2-4-15(22)9-13/h2-10,29H,11H2,1H3
InChIKey NAOAKEYFANBGLI-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_22614
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: 2228808; UZI_ID: UZI-022622
Temperature 308 °C