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Propenone, 1-(4-fluorophenyl)-3-(5-methyl-2-benzimidazolylthio)-
SpectraBase Compound ID K6Ort6Em6Sz
InChI InChI=1S/C17H13FN2OS/c1-11-2-7-14-15(10-11)20-17(19-14)22-9-8-16(21)12-3-5-13(18)6-4-12/h2-10H,1H3,(H,19,20)/b9-8+
InChIKey XGSKRLDYDQEMSI-CMDGGOBGSA-N
Mol Weight 312.36 g/mol
Molecular Formula C17H13FN2OS
Exact Mass 312.073262 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5TEGoXLXWc1
Name Propenone, 1-(4-fluorophenyl)-3-(5-methyl-2-benzimidazolylthio)-
Alternate Name(s) (2E)-1-(4-Fluorophenyl)-3-[(5-methyl-1H-benzimidazol-2-yl)sulfanyl]-2-propen-1-one (E)-1-(4-fluorophenyl)-3-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]prop-2-en-1-one (E)-1-(4-fluorophenyl)-3-[(6-methyl-1H-benzimidazol-2-yl)thio]-2-propen-1-one (E)-1-(4-fluorophenyl)-3-[(6-methyl-1H-benzimidazol-2-yl)thio]prop-2-en-1-one 1-(4-Fluorophenyl)-3-[(5-methyl-1H-benzimidazol-2-yl)sulfanyl]-2-propen-1-one
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Formula C17H13FN2OS
InChI InChI=1S/C17H13FN2OS/c1-11-2-7-14-15(10-11)20-17(19-14)22-9-8-16(21)12-3-5-13(18)6-4-12/h2-10H,1H3,(H,19,20)/b9-8+
InChIKey XGSKRLDYDQEMSI-CMDGGOBGSA-N
Molecular Weight 312.362 g/mol
SMILES [nH]1c2c(nc1S\C=C\C(c1ccc(cc1)F)=O)cc(cc2)C
SPLASH splash10-000j-5900000000-1e7852b0cc26260e987a
Source of Spectrum AD-0-2532-0
Wiley ID 1424761