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4-{4-[chloro(difluoro)methyl]-1,3-dimethyl-1H-pyrazolo[3,4-b]pyridin-6-yl}phenyl methyl ether
SpectraBase Compound ID BDaPmo6nlJi
InChI InChI=1S/C16H14ClF2N3O/c1-9-14-12(16(17,18)19)8-13(20-15(14)22(2)21-9)10-4-6-11(23-3)7-5-10/h4-8H,1-3H3
InChIKey QMVBPWDYIMXHHR-UHFFFAOYSA-N
Mol Weight 337.76 g/mol
Molecular Formula C16H14ClF2N3O
Exact Mass 337.079346 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5KmKAkoq4ES
Name 4-{4-[chloro(difluoro)methyl]-1,3-dimethyl-1H-pyrazolo[3,4-b]pyridin-6-yl}phenyl methyl ether
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/C16H14ClF2N3O/c1-9-14-12(16(17,18)19)8-13(20-15(14)22(2)21-9)10-4-6-11(23-3)7-5-10/h4-8H,1-3H3
InChIKey QMVBPWDYIMXHHR-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_30909
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: 1728046; SBI_ID: SBI-030913
Synonyms 4-[chloro(difluoro)methyl]-6-(4-methoxyphenyl)-1,3-dimethyl-1H-pyrazolo[3,4-b]pyridine
Temperature 306 °C