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(Furan-2-yl)-6-hydroxy-1-methyl-2-(methylthio)-6-(trifluoromethyl)-1,6-dihydropyrimidin-5-yl)metanone
SpectraBase Compound ID 1Sqoicl93jy
InChI InChI=1S/C12H11F3N2O3S/c1-17-10(21-2)16-6-7(11(17,19)12(13,14)15)9(18)8-4-3-5-20-8/h3-6,19H,1-2H3
InChIKey DTVRKJDCQXXUMF-UHFFFAOYSA-N
Mol Weight 320.29 g/mol
Molecular Formula C12H11F3N2O3S
Exact Mass 320.044248 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID yef9XGWbM6
Name (Furan-2-yl)-6-hydroxy-1-methyl-2-(methylthio)-6-(trifluoromethyl)-1,6-dihydropyrimidin-5-yl)metanone
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11F3N2O3S
InChI InChI=1S/C12H11F3N2O3S/c1-17-10(21-2)16-6-7(11(17,19)12(13,14)15)9(18)8-4-3-5-20-8/h3-6,19H,1-2H3
InChIKey DTVRKJDCQXXUMF-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202000879
Molecular Weight 320.286 g/mol
SMILES OC1(C(C(=O)c2occc2)=CN=C(SC)N1C)C(F)(F)F
SPLASH splash10-001i-0940000000-cff8a9e827db202a571a
Source of Spectrum U1-2020-5532-3j
Wiley ID 1860903