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1-(4-butoxy-3-{[4,6-dihydroxy-2-(methylsulfanyl)-5-pyrimidinyl]methyl}phenyl)ethanone
SpectraBase Compound ID 3zryg4EwKvj
InChI InChI=1S/C18H22N2O4S/c1-4-5-8-24-15-7-6-12(11(2)21)9-13(15)10-14-16(22)19-18(25-3)20-17(14)23/h6-7,9H,4-5,8,10H2,1-3H3,(H2,19,20,22,23)
InChIKey KQJBUAUGUPWWCZ-UHFFFAOYSA-N
Mol Weight 362.44 g/mol
Molecular Formula C18H22N2O4S
Exact Mass 362.130028 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1YFL8wWnRIR
Name 1-(4-butoxy-3-{[4,6-dihydroxy-2-(methylsulfanyl)-5-pyrimidinyl]methyl}phenyl)ethanone
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C18H22N2O4S/c1-4-5-8-24-15-7-6-12(11(2)21)9-13(15)10-14-16(22)19-18(25-3)20-17(14)23/h6-7,9H,4-5,8,10H2,1-3H3,(H2,19,20,22,23)
InChIKey KQJBUAUGUPWWCZ-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_12645
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: 100426; Labnumber: LAM-111; VK_ID: VK-012650
Temperature 318 °C