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N-Phenylethynyl-S-methyl-S-(4-fluorophenyl)sulfoximine
SpectraBase Compound ID GM5cAxNE5PT
InChI InChI=1S/C15H12FNOS/c1-19(18,15-9-7-14(16)8-10-15)17-12-11-13-5-3-2-4-6-13/h2-10H,1H3
InChIKey BHQNSPREOAVWJI-UHFFFAOYSA-N
Mol Weight 273.33 g/mol
Molecular Formula C15H12FNOS
Exact Mass 273.062363 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FtkkiCr2M6C
Name N-Phenylethynyl-S-methyl-S-(4-fluorophenyl)sulfoximine
Appearance Pale yellow oil
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Exact Mass 273.062363346 u
Formula C15H12FNOS
InChI InChI=1S/C15H12FNOS/c1-19(18,15-9-7-14(16)8-10-15)17-12-11-13-5-3-2-4-6-13/h2-10H,1H3
InChIKey BHQNSPREOAVWJI-UHFFFAOYSA-N
Instrument Name Finnigan SSQ Finnigan 7000
Ionization Type EI
Literature Reference DOI 10.1002/anie.201605743
Molecular Weight 273.325 g/mol
Quality 29
Reported Formula C15H12FNOS
SMILES C1(=CC=C(C=C1)F)S(=NC#CC1=CC=CC=C1)(=O)C
SPLASH splash10-0006-4900000000-4a6a10e2a17717165ad0
Source of Spectrum ACI-55-SM13-5ba (DOI: 10.1002/anie.201605743)
Wiley ID 1899275