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6H-pyrazolo[3,4-b]pyridin-6-one, 1-(4,6-dimethyl-2-pyrimidinyl)-1,4,5,7-tetrahydro-3-methyl-4-[4-(methylthio)phenyl]-
SpectraBase Compound ID GHn4j0U70GU
InChI InChI=1S/C20H21N5OS/c1-11-9-12(2)22-20(21-11)25-19-18(13(3)24-25)16(10-17(26)23-19)14-5-7-15(27-4)8-6-14/h5-9,16H,10H2,1-4H3,(H,23,26)
InChIKey QPJXOXRZDRCDMS-UHFFFAOYSA-N
Mol Weight 379.48 g/mol
Molecular Formula C20H21N5OS
Exact Mass 379.146681 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GPu1Uu47t6E
Name 6H-pyrazolo[3,4-b]pyridin-6-one, 1-(4,6-dimethyl-2-pyrimidinyl)-1,4,5,7-tetrahydro-3-methyl-4-[4-(methylthio)phenyl]-
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/C20H21N5OS/c1-11-9-12(2)22-20(21-11)25-19-18(13(3)24-25)16(10-17(26)23-19)14-5-7-15(27-4)8-6-14/h5-9,16H,10H2,1-4H3,(H,23,26)
InChIKey QPJXOXRZDRCDMS-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_3237
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: F17377; Labnumber: MAVAS-S1202-2126