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2-(benzylsulfanyl)-5-(4-isopropoxy-3-methylbenzyl)-4,6-pyrimidinediol

View entire compound with spectra: 1 NMR

2-(benzylsulfanyl)-5-(4-isopropoxy-3-methylbenzyl)-4,6-pyrimidinediol
SpectraBase Compound ID 8IAku9rVUAg
InChI InChI=1S/C22H24N2O3S/c1-14(2)27-19-10-9-17(11-15(19)3)12-18-20(25)23-22(24-21(18)26)28-13-16-7-5-4-6-8-16/h4-11,14H,12-13H2,1-3H3,(H2,23,24,25,26)
InChIKey VDPXLAHLNQZUBC-UHFFFAOYSA-N
Mol Weight 396.51 g/mol
Molecular Formula C22H24N2O3S
Exact Mass 396.150764 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JXA7iv1ftzS
Name 2-(benzylsulfanyl)-5-(4-isopropoxy-3-methylbenzyl)-4,6-pyrimidinediol
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/C22H24N2O3S/c1-14(2)27-19-10-9-17(11-15(19)3)12-18-20(25)23-22(24-21(18)26)28-13-16-7-5-4-6-8-16/h4-11,14H,12-13H2,1-3H3,(H2,23,24,25,26)
InChIKey VDPXLAHLNQZUBC-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_12378
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: 100483; Labnumber: LAM-207; VK_ID: VK-012383
Temperature 318 °C