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3-(3-Fluorophenyl)-N-[methyl(oxo)(phenyl)-lamda6-sulfaneylidene]propiolamide
SpectraBase Compound ID 9wBipjItZ0T
InChI InChI=1S/C16H12FNO2S/c1-21(20,15-8-3-2-4-9-15)18-16(19)11-10-13-6-5-7-14(17)12-13/h2-9,12H,1H3
InChIKey QCNHFCCYRRULQR-UHFFFAOYSA-N
Mol Weight 301.34 g/mol
Molecular Formula C16H12FNO2S
Exact Mass 301.057278 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E6dVyL8dLkI
Name 3-(3-Fluorophenyl)-N-[methyl(oxo)(phenyl)-lamda6-sulfaneylidene]propiolamide
Appearance Orange oil
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Formula C16H12FNO2S
InChI InChI=1S/C16H12FNO2S/c1-21(20,15-8-3-2-4-9-15)18-16(19)11-10-13-6-5-7-14(17)12-13/h2-9,12H,1H3
InChIKey QCNHFCCYRRULQR-UHFFFAOYSA-N
Instrument Name Finnigan SSQ-7000
Ionization Type EI
Literature Reference DOI 10.1002/adsc.202001440
Molecular Weight 301.335 g/mol
Reported Formula C16H12FNO2S
SMILES c1cc(ccc1)S(=NC(C#Cc1cc(ccc1)F)=O)(C)=O
SPLASH splash10-052b-0940000000-a4e6b97e3a36730c0ae8
Source of Spectrum ASC-363-SM16-2ma
Wiley ID 1856415