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{[3-(4-Fluorophenyl)-1,2,4-oxadiazol-5-yl]imino}(methyl)(phenyl)-.lambda.6-sulfanone
SpectraBase Compound ID 3KRVifBffif
InChI InChI=1S/C15H12FN3O2S/c1-22(20,13-5-3-2-4-6-13)19-15-17-14(18-21-15)11-7-9-12(16)10-8-11/h2-10H,1H3
InChIKey GQOBKTUDIKSMMU-UHFFFAOYSA-N
Mol Weight 317.34 g/mol
Molecular Formula C15H12FN3O2S
Exact Mass 317.063426 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 13x3GrA16Y2
Name {[3-(4-Fluorophenyl)-1,2,4-oxadiazol-5-yl]imino}(methyl)(phenyl)-.lambda.6-sulfanone
Appearance Colorless solid
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Formula C15H12FN3O2S
InChI InChI=1S/C15H12FN3O2S/c1-22(20,13-5-3-2-4-6-13)19-15-17-14(18-21-15)11-7-9-12(16)10-8-11/h2-10H,1H3
InChIKey GQOBKTUDIKSMMU-UHFFFAOYSA-N
Instrument Name Finnigan SSQ 7000
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202000335
Molecular Weight 317.338 g/mol
Reported Formula C15H12O2N3FS
SMILES CS(c1ccccc1)(=Nc1onc(-c2ccc(cc2)F)n1)=O
SPLASH splash10-02t9-2769000000-0200058b2e4441e0f844
Source of Spectrum U1-2020-SM11-9l
Wiley ID 1860543