For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
2-{[1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl}-N-(4-phenoxyphenyl)acetamide
SpectraBase Compound ID F3UnVpa6qq6
InChI InChI=1S/C26H21N5O2S/c1-18-7-11-20(12-8-18)31-25-23(15-29-31)26(28-17-27-25)34-16-24(32)30-19-9-13-22(14-10-19)33-21-5-3-2-4-6-21/h2-15,17H,16H2,1H3,(H,30,32)
InChIKey XREWAHBWYCOFOY-UHFFFAOYSA-N
Mol Weight 467.55 g/mol
Molecular Formula C26H21N5O2S
Exact Mass 467.141596 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID DZV0ww6C9kM
Name 2-{[1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl}-N-(4-phenoxyphenyl)acetamide
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/C26H21N5O2S/c1-18-7-11-20(12-8-18)31-25-23(15-29-31)26(28-17-27-25)34-16-24(32)30-19-9-13-22(14-10-19)33-21-5-3-2-4-6-21/h2-15,17H,16H2,1H3,(H,30,32)
InChIKey XREWAHBWYCOFOY-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_9909
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: D62180; Labnumber: UDSG-05845; SBI_ID: SBI-009912
Temperature 315 °C