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5-(3-methyl-4-propoxybenzyl)-2-(methylsulfanyl)-4,6-pyrimidinediol
SpectraBase Compound ID 3PV4A8hPJBY
InChI InChI=1S/C16H20N2O3S/c1-4-7-21-13-6-5-11(8-10(13)2)9-12-14(19)17-16(22-3)18-15(12)20/h5-6,8H,4,7,9H2,1-3H3,(H2,17,18,19,20)
InChIKey MFHNFKIOQGPREH-UHFFFAOYSA-N
Mol Weight 320.41 g/mol
Molecular Formula C16H20N2O3S
Exact Mass 320.119464 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HolB0Mx4uNb
Name 5-(3-methyl-4-propoxybenzyl)-2-(methylsulfanyl)-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/C16H20N2O3S/c1-4-7-21-13-6-5-11(8-10(13)2)9-12-14(19)17-16(22-3)18-15(12)20/h5-6,8H,4,7,9H2,1-3H3,(H2,17,18,19,20)
InChIKey MFHNFKIOQGPREH-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_12662
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: 100460; Labnumber: LAM-166; VK_ID: VK-012667
Temperature 318 °C