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[2-Bromo-4-(trifluoromethyl)phenyl](imino)(phenyl)-.lambda.6-sulfanone
SpectraBase Compound ID AYQPBXYoS2E
InChI InChI=1S/C13H9BrF3NOS/c14-11-8-9(13(15,16)17)6-7-12(11)20(18,19)10-4-2-1-3-5-10/h1-8,18H
InChIKey SDFQVSHKXMREIW-UHFFFAOYSA-N
Mol Weight 364.18 g/mol
Molecular Formula C13H9BrF3NOS
Exact Mass 362.954033 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3TJLfx6aHo
Name [2-Bromo-4-(trifluoromethyl)phenyl](imino)(phenyl)-.lambda.6-sulfanone
Appearance Yellow solid
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Exact Mass 362.954032576 u
Formula C13H9BrF3NOS
InChI InChI=1S/C13H9BrF3NOS/c14-11-8-9(13(15,16)17)6-7-12(11)20(18,19)10-4-2-1-3-5-10/h1-8,18H
InChIKey SDFQVSHKXMREIW-UHFFFAOYSA-N
Instrument Name Finnigan SSQ 7000
Ionization Type EI
Literature Reference DOI 10.1002/adsc.202201408
Molecular Weight 364.180 g/mol
Quality 67
Reported Formula C13H9ONF3BrS
SMILES N=S(C1=C(Br)C=C(C=C1)C(F)(F)F)(C1=CC=CC=C1)=O
SPLASH splash10-03fu-8709000000-3220107dfaecaa0a6456
Source of Spectrum ASC-365-SM13-1u (DOI: 10.1002/adsc.202201408)
Wiley ID 1902680