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(E)-1-Nitro-2-(4-methoxystyryl)-4-(pentafluorosulfanyl)benzene
SpectraBase Compound ID L9BE3BYAqGW
InChI InChI=1S/C15H12F5NO3S/c1-24-13-6-3-11(4-7-13)2-5-12-10-14(25(16,17,18,19)20)8-9-15(12)21(22)23/h2-10H,1H3/b5-2+
InChIKey XPCKYMRTRZIOHX-GORDUTHDSA-N
Mol Weight 381.32 g/mol
Molecular Formula C15H12F5NO3S
Exact Mass 381.045805 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JgbKh89YmMb
Name (E)-1-Nitro-2-(4-methoxystyryl)-4-(pentafluorosulfanyl)benzene
Appearance Orange solid
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Formula C15H12F5NO3S
InChI InChI=1S/C15H12F5NO3S/c1-24-13-6-3-11(4-7-13)2-5-12-10-14(25(16,17,18,19)20)8-9-15(12)21(22)23/h2-10H,1H3/b5-2+
InChIKey XPCKYMRTRZIOHX-GORDUTHDSA-N
Instrument Name Agilent 7890A-5975C
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.8.131
Molecular Weight 381.317 g/mol
Reported Formula C15H12F5NO3S
SMILES c1([N+](=O)[O-])c(cc(cc1)S(F)(F)(F)(F)F)\C=C\c1ccc(cc1)OC
SPLASH splash10-000i-0902000000-08c940226327947f418e
Source of Spectrum BJO-8-SM3-5d
Thin-Layer Chromatography Rf = 0.25 (hexane/EtOAc, 95:5)
Wiley ID 1864902