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2-(4-fluorophenyl)-2,3-dihydro-1-benzothiopyran-4-one
SpectraBase Compound ID 9Vf3mClra5S
InChI InChI=1S/C15H11FOS/c16-11-7-5-10(6-8-11)15-9-13(17)12-3-1-2-4-14(12)18-15/h1-8,15H,9H2
InChIKey ZMVXSDSMRWCLQY-UHFFFAOYSA-N
Mol Weight 258.31 g/mol
Molecular Formula C15H11FOS
Exact Mass 258.051464 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BtLIxE3PuEm
Name 2-(4-fluorophenyl)-2,3-dihydro-1-benzothiopyran-4-one
Alternate Name(s) 2-(4-fluorophenyl)-2,3-dihydrothiochromen-4-one 2-(4-fluorophenyl)thiochroman-4-one
Comments Less than 3 mono-isotopic peaks
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Formula C15H11FOS
InChI InChI=1S/C15H11FOS/c16-11-7-5-10(6-8-11)15-9-13(17)12-3-1-2-4-14(12)18-15/h1-8,15H,9H2
InChIKey ZMVXSDSMRWCLQY-UHFFFAOYSA-N
Molecular Weight 258.310 g/mol
SMILES c12SC(CC(c2cccc1)=O)c1ccc(cc1)F
SPLASH splash10-000i-0930000000-4faf2fcbe8926b5df367
Source of Spectrum SK-25-1505-4
Wiley ID 866689