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

*Links on SpectraBase are not permalinks.
1-(2,5-dimethoxyphenyl)-2-[(1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl]ethanone
SpectraBase Compound ID 2GcaUsFZWJ3
InChI InChI=1S/C21H18N4O3S/c1-27-15-8-9-19(28-2)16(10-15)18(26)12-29-21-17-11-24-25(20(17)22-13-23-21)14-6-4-3-5-7-14/h3-11,13H,12H2,1-2H3
InChIKey YBOPSEIFDRKKPD-UHFFFAOYSA-N
Mol Weight 406.46 g/mol
Molecular Formula C21H18N4O3S
Exact Mass 406.109962 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 6Rk7HUyIFnL
Name 1-(2,5-dimethoxyphenyl)-2-[(1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl]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/C21H18N4O3S/c1-27-15-8-9-19(28-2)16(10-15)18(26)12-29-21-17-11-24-25(20(17)22-13-23-21)14-6-4-3-5-7-14/h3-11,13H,12H2,1-2H3
InChIKey YBOPSEIFDRKKPD-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_26164
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: D62054; Labnumber: UDSG-05670; SBI_ID: SBI-026168
Temperature 308 °C