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3-benzyl-8-(benzylsulfanyl)-3H-purin-6-ylamine

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3-benzyl-8-(benzylsulfanyl)-3H-purin-6-ylamine
SpectraBase Compound ID LT0ARx1HgsI
InChI InChI=1S/C19H17N5S/c20-17-16-18(24(13-21-17)11-14-7-3-1-4-8-14)23-19(22-16)25-12-15-9-5-2-6-10-15/h1-10,13H,11-12,20H2
InChIKey PTYOWCLFBBBYGH-UHFFFAOYSA-N
Mol Weight 347.44 g/mol
Molecular Formula C19H17N5S
Exact Mass 347.120467 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FsMKzv62g8m
Name 3-benzyl-8-(benzylsulfanyl)-3H-purin-6-ylamine
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/C19H17N5S/c20-17-16-18(24(13-21-17)11-14-7-3-1-4-8-14)23-19(22-16)25-12-15-9-5-2-6-10-15/h1-10,13H,11-12,20H2
InChIKey PTYOWCLFBBBYGH-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_7529_3309
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: NMR/10211800; Labnumber: JSA-0000102
Temperature 297 °C