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2-[(1-benzyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl]-1-(3,4-dimethoxyphenyl)ethanone

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2-[(1-benzyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl]-1-(3,4-dimethoxyphenyl)ethanone
SpectraBase Compound ID 2ztubNW7mbM
InChI InChI=1S/C22H20N4O3S/c1-28-19-9-8-16(10-20(19)29-2)18(27)13-30-22-17-11-25-26(21(17)23-14-24-22)12-15-6-4-3-5-7-15/h3-11,14H,12-13H2,1-2H3
InChIKey SEBCHSZDIIYSPJ-UHFFFAOYSA-N
Mol Weight 420.49 g/mol
Molecular Formula C22H20N4O3S
Exact Mass 420.125612 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LAPc8wpsHTH
Name 2-[(1-benzyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl]-1-(3,4-dimethoxyphenyl)ethanone
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/C22H20N4O3S/c1-28-19-9-8-16(10-20(19)29-2)18(27)13-30-22-17-11-25-26(21(17)23-14-24-22)12-15-6-4-3-5-7-15/h3-11,14H,12-13H2,1-2H3
InChIKey SEBCHSZDIIYSPJ-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_10032
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: D62453; Labnumber: UDSG-06653; SBI_ID: SBI-010035
Temperature 318 °C