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5-(4-fluorobenzyl)-6-methyl-2-sulfanyl-4-pyrimidinol
SpectraBase Compound ID 6JyLlcH579r
InChI InChI=1S/C12H11FN2OS/c1-7-10(11(16)15-12(17)14-7)6-8-2-4-9(13)5-3-8/h2-5H,6H2,1H3,(H2,14,15,16,17)
InChIKey FQTSAGYEEWAYQZ-UHFFFAOYSA-N
Mol Weight 250.29 g/mol
Molecular Formula C12H11FN2OS
Exact Mass 250.057612 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 18hyYxD10Oy
Name 5-(4-fluorobenzyl)-6-methyl-2-sulfanyl-4-pyrimidinol
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/C12H11FN2OS/c1-7-10(11(16)15-12(17)14-7)6-8-2-4-9(13)5-3-8/h2-5H,6H2,1H3,(H2,14,15,16,17)
InChIKey FQTSAGYEEWAYQZ-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_27262
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: D75765; Labnumber: OBMBB-0041; SBI_ID: SBI-027266
Temperature 306 °C