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1-benzyl-4-[(4-nitrobenzyl)sulfanyl]-1H-pyrazolo[3,4-d]pyrimidine
SpectraBase Compound ID 40KcKERejdb
InChI InChI=1S/C19H15N5O2S/c25-24(26)16-8-6-15(7-9-16)12-27-19-17-10-22-23(18(17)20-13-21-19)11-14-4-2-1-3-5-14/h1-10,13H,11-12H2
InChIKey SQLPNFYPEOLVDY-UHFFFAOYSA-N
Mol Weight 377.42 g/mol
Molecular Formula C19H15N5O2S
Exact Mass 377.094646 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Ibb7UzSS4Qj
Name 1-benzyl-4-[(4-nitrobenzyl)sulfanyl]-1H-pyrazolo[3,4-d]pyrimidine
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/C19H15N5O2S/c25-24(26)16-8-6-15(7-9-16)12-27-19-17-10-22-23(18(17)20-13-21-19)11-14-4-2-1-3-5-14/h1-10,13H,11-12H2
InChIKey SQLPNFYPEOLVDY-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_10059
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: D62485; Labnumber: UDSG-06696; SBI_ID: SBI-010062
Synonyms 1-benzyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl 4-nitrobenzyl sulfide
Temperature 318 °C