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(E)-N-[2-(4-Bromo-phenylvinyl)-2-benzoyloxy]-S-methyl-S-phenylsulfoximine
SpectraBase Compound ID 8zVoZhVAnfK
InChI InChI=1S/C22H18BrNO3S/c1-28(26,20-10-6-3-7-11-20)24-21(16-17-12-14-19(23)15-13-17)27-22(25)18-8-4-2-5-9-18/h2-16H,1H3/b21-16+
InChIKey NKQSBCDDEZUXBF-LTGZKZEYSA-N
Mol Weight 456.35 g/mol
Molecular Formula C22H18BrNO3S
Exact Mass 455.019078 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H0ghvJU2p8n
Name (E)-N-[2-(4-Bromo-phenylvinyl)-2-benzoyloxy]-S-methyl-S-phenylsulfoximine
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Formula C22H18BrNO3S
InChI InChI=1S/C22H18BrNO3S/c1-28(26,20-10-6-3-7-11-20)24-21(16-17-12-14-19(23)15-13-17)27-22(25)18-8-4-2-5-9-18/h2-16H,1H3/b21-16+
InChIKey NKQSBCDDEZUXBF-LTGZKZEYSA-N
Literature Reference DOI 10.1021/acs.orglett.5b02477
Molecular Weight 456.354 g/mol
SMILES c1(\C=C/(N=S(C)(c2ccccc2)=O)OC(c2ccccc2)=O)ccc(cc1)Br
SPLASH splash10-003r-2900000000-15aaacc5a1cdf3a118ae
Source of Spectrum A1-17-5008/SM7-6h
Synonyms (E)-2-(4-bromophenyl)-1-((methyl(oxo)(phenyl)-lambda6-sulfaneylidene)amino)vinyl benzoate
Wiley ID 1802535