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1-methyl-4-[(E)-2-phenyl-2-[(trifluoromethyl)selanyl]ethenesulfonyl]benzene
SpectraBase Compound ID HYGZRFz8qzu
InChI InChI=1S/C16H13F3O2SSe/c1-12-7-9-14(10-8-12)22(20,21)11-15(23-16(17,18)19)13-5-3-2-4-6-13/h2-11H,1H3/b15-11+
InChIKey OSBSDIZPONGUJL-RVDMUPIBSA-N
Mol Weight 405.31 g/mol
Molecular Formula C16H13F3O2SSe
Exact Mass 405.975357 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ctvz20xeepV
Name 1-methyl-4-[(E)-2-phenyl-2-[(trifluoromethyl)selanyl]ethenesulfonyl]benzene
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13F3O2SSe
InChI InChI=1S/C16H13F3O2SSe/c1-12-7-9-14(10-8-12)22(20,21)11-15(23-16(17,18)19)13-5-3-2-4-6-13/h2-11H,1H3/b15-11+
InChIKey OSBSDIZPONGUJL-RVDMUPIBSA-N
Instrument Name Agilent HP 5890-5973
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.13.260
Molecular Weight 405.305 g/mol
SMILES c1cc(ccc1)\C([Se]C(F)(F)F)=C/S(=O)(=O)c1ccc(cc1)C
SPLASH splash10-052f-4901100000-85bc5c0d737e8ce495a3
Source of Spectrum BJO-13-SM17-3a
Wiley ID 1848298