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

*Links on SpectraBase are not permalinks.
2-[(1-benzyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl]-N-(3-bromophenyl)acetamide
SpectraBase Compound ID 8aHuxo1wpmw
InChI InChI=1S/C20H16BrN5OS/c21-15-7-4-8-16(9-15)25-18(27)12-28-20-17-10-24-26(19(17)22-13-23-20)11-14-5-2-1-3-6-14/h1-10,13H,11-12H2,(H,25,27)
InChIKey IQQGMUQBUJGLPW-UHFFFAOYSA-N
Mol Weight 454.35 g/mol
Molecular Formula C20H16BrN5OS
Exact Mass 453.025894 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 BUUcF6XvXkK
Name 2-[(1-benzyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl]-N-(3-bromophenyl)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/C20H16BrN5OS/c21-15-7-4-8-16(9-15)25-18(27)12-28-20-17-10-24-26(19(17)22-13-23-20)11-14-5-2-1-3-6-14/h1-10,13H,11-12H2,(H,25,27)
InChIKey IQQGMUQBUJGLPW-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_26214
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: D62521; Labnumber: UDSG-06752; SBI_ID: SBI-026218
Temperature 308 °C