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1-(4-Fluorophenyl)-2-[(4-hydroxy-6-methyl-2-pyrimidinyl)sulfanyl]ethanone
SpectraBase Compound ID ykaFJMddKq
InChI InChI=1S/C13H11FN2O2S/c1-8-6-12(18)16-13(15-8)19-7-11(17)9-2-4-10(14)5-3-9/h2-6H,7H2,1H3,(H,15,16,18)
InChIKey NRUFGKXAWWWDRO-UHFFFAOYSA-N
Mol Weight 278.3 g/mol
Molecular Formula C13H11FN2O2S
Exact Mass 278.052527 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9ZZmthk2HAI
Name 1-(4-Fluorophenyl)-2-[(4-hydroxy-6-methyl-2-pyrimidinyl)sulfanyl]ethanone
CAS Registry Number 119730-11-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H11FN2O2S
InChI InChI=1S/C13H11FN2O2S/c1-8-6-12(18)16-13(15-8)19-7-11(17)9-2-4-10(14)5-3-9/h2-6H,7H2,1H3,(H,15,16,18)
InChIKey NRUFGKXAWWWDRO-UHFFFAOYSA-N
Molecular Weight 278.301 g/mol
SMILES Oc1nc(nc(c1)C)SCC(c1ccc(cc1)F)=O
SPLASH splash10-00di-5910000000-aa3dcc7a304e34abd626
Source of Spectrum AD-0-2532-0
Synonyms 1-(4-Fluorophenyl)-2-[(4-hydroxy-6-methylpyrimidin-2-yl)thio]ethan-1-one 2-[2-(4-fluorophenyl)-2-oxidanylidene-ethyl]sulfanyl-6-methyl-1H-pyrimidin-4-one 2-[2-(4-fluorophenyl)-2-oxo-ethyl]sulfanyl-6-methyl-1H-pyrimidin-4-one 2-[[2-(4-fluorophenyl)-2-keto-ethyl]thio]-6-methyl-1H-pyrimidin-4-one 2-[[2-(4-fluorophenyl)-2-oxoethyl]thio]-6-methyl-1H-pyrimidin-4-one
Wiley ID 1433224