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(Z)-N-{2-Bromo-2-[(2-cyanophenoxy)carbonyl]}vinyl-S-phenyl-S-methyl sulfoximine
SpectraBase Compound ID 5QbaAtZ547B
InChI InChI=1S/C17H13BrN2O3S/c1-24(22,14-8-3-2-4-9-14)20-12-15(18)17(21)23-16-10-6-5-7-13(16)11-19/h2-10,12H,1H3/b15-12-
InChIKey VFWVPZDQCLFBFA-QINSGFPZSA-N
Mol Weight 405.27 g/mol
Molecular Formula C17H13BrN2O3S
Exact Mass 403.983026 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DZXzVcTw3NW
Name (Z)-N-{2-Bromo-2-[(2-cyanophenoxy)carbonyl]}vinyl-S-phenyl-S-methyl sulfoximine
Appearance White solid
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Exact Mass 403.983026458 u
Formula C17H13BrN2O3S
InChI InChI=1S/C17H13BrN2O3S/c1-24(22,14-8-3-2-4-9-14)20-12-15(18)17(21)23-16-10-6-5-7-13(16)11-19/h2-10,12H,1H3/b15-12-
InChIKey VFWVPZDQCLFBFA-QINSGFPZSA-N
Instrument Name Finnigan SSQ 7000
Ionization Type EI
Literature Reference DOI 10.1002/chem.201501629
Molecular Weight 405.266 g/mol
Quality 193
Reported Formula C17H13O3N2BrS
SMILES C1(OC(=O)\C(=C\N=S(=O)(C2=CC=CC=C2)C)Br)=CC=CC=C1C#N
SPLASH splash10-004i-9600000000-2675b9e288e20ed57f0d
Source of Spectrum QE-21-SM5-3h (DOI: 10.1002/chem.201501629)
Wiley ID 1906780