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(Z)-N-[2-Bromo-2-(n-butoxycarbonyl)]vinyl-S-phenyl-S-methyl sulfoximine
SpectraBase Compound ID FSB5BUchH7D
InChI InChI=1S/C14H18BrNO3S/c1-3-4-10-19-14(17)13(15)11-16-20(2,18)12-8-6-5-7-9-12/h5-9,11H,3-4,10H2,1-2H3/b13-11-
InChIKey MEEOJAFWKFEEFH-QBFSEMIESA-N
Mol Weight 360.27 g/mol
Molecular Formula C14H18BrNO3S
Exact Mass 359.019078 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 13cM4WgcFM
Name (Z)-N-[2-Bromo-2-(n-butoxycarbonyl)]vinyl-S-phenyl-S-methyl sulfoximine
Appearance Yellow oil
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Exact Mass 359.019077615 u
Formula C14H18BrNO3S
InChI InChI=1S/C14H18BrNO3S/c1-3-4-10-19-14(17)13(15)11-16-20(2,18)12-8-6-5-7-9-12/h5-9,11H,3-4,10H2,1-2H3/b13-11-
InChIKey MEEOJAFWKFEEFH-QBFSEMIESA-N
Instrument Name Finnigan SSQ 7000
Ionization Type EI
Literature Reference DOI 10.1002/chem.201501629
Molecular Weight 360.266 g/mol
Quality 247
Reported Formula C14H18NO3SBr
SMILES C(OC(=O)\C(=C\N=S(=O)(C1=CC=CC=C1)C)Br)CCC
SPLASH splash10-0btc-1769000000-9a4943be4ae3358c4d8d
Source of Spectrum QE-21-SM3-3b (DOI: 10.1002/chem.201501629)
Wiley ID 1906774