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6H-pyrazolo[3,4-b]pyridin-6-one, 1-(1H-benzimidazol-2-yl)-4-(1,3-benzodioxol-5-yl)-1,4,5,7-tetrahydro-3-methyl-
SpectraBase Compound ID 5ywmyPr8P5I
InChI InChI=1S/C21H17N5O3/c1-11-19-13(12-6-7-16-17(8-12)29-10-28-16)9-18(27)24-20(19)26(25-11)21-22-14-4-2-3-5-15(14)23-21/h2-8,13H,9-10H2,1H3,(H,22,23)(H,24,27)
InChIKey XLBHQWNWXNHLTG-UHFFFAOYSA-N
Mol Weight 387.4 g/mol
Molecular Formula C21H17N5O3
Exact Mass 387.133139 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9XIpTfJ60Jc
Name 6H-pyrazolo[3,4-b]pyridin-6-one, 1-(1H-benzimidazol-2-yl)-4-(1,3-benzodioxol-5-yl)-1,4,5,7-tetrahydro-3-methyl-
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/C21H17N5O3/c1-11-19-13(12-6-7-16-17(8-12)29-10-28-16)9-18(27)24-20(19)26(25-11)21-22-14-4-2-3-5-15(14)23-21/h2-8,13H,9-10H2,1H3,(H,22,23)(H,24,27)
InChIKey XLBHQWNWXNHLTG-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_3597
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: NMR/17231318; Labnumber: DUD-7030116