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2-chlorobenzyl 1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl sulfide

View entire compound with spectra: 1 NMR

2-chlorobenzyl 1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl sulfide
SpectraBase Compound ID EgApIQr1WTk
InChI InChI=1S/C18H12Cl2N4S/c19-13-5-7-14(8-6-13)24-17-15(9-23-24)18(22-11-21-17)25-10-12-3-1-2-4-16(12)20/h1-9,11H,10H2
InChIKey DHFDFVAAEZJEGP-UHFFFAOYSA-N
Mol Weight 387.29 g/mol
Molecular Formula C18H12Cl2N4S
Exact Mass 386.015973 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1ksX1NR7J20
Name 2-chlorobenzyl 1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl sulfide
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/C18H12Cl2N4S/c19-13-5-7-14(8-6-13)24-17-15(9-23-24)18(22-11-21-17)25-10-12-3-1-2-4-16(12)20/h1-9,11H,10H2
InChIKey DHFDFVAAEZJEGP-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_10001
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: D62367; Labnumber: UDSG-06262; SBI_ID: SBI-010004
Synonyms 4-[(2-chlorobenzyl)sulfanyl]-1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidine
Temperature 308 °C