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1-[(E)-2-(2-chlorophenyl)-2-[(trifluoromethyl)selanyl]ethenesulfonyl]-4-methylbenzene
SpectraBase Compound ID 4z4KxLjeApQ
InChI InChI=1S/C16H12ClF3O2SSe/c1-11-6-8-12(9-7-11)23(21,22)10-15(24-16(18,19)20)13-4-2-3-5-14(13)17/h2-10H,1H3/b15-10+
InChIKey ZFVDPTUFXAWSEM-XNTDXEJSSA-N
Mol Weight 439.75 g/mol
Molecular Formula C16H12ClF3O2SSe
Exact Mass 439.936385 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5MqEkfDOXnF
Name 1-[(E)-2-(2-chlorophenyl)-2-[(trifluoromethyl)selanyl]ethenesulfonyl]-4-methylbenzene
Appearance Yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12ClF3O2SSe
InChI InChI=1S/C16H12ClF3O2SSe/c1-11-6-8-12(9-7-11)23(21,22)10-15(24-16(18,19)20)13-4-2-3-5-14(13)17/h2-10H,1H3/b15-10+
InChIKey ZFVDPTUFXAWSEM-XNTDXEJSSA-N
Instrument Name Agilent HP 5890-5973
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.13.260
Molecular Weight 439.750 g/mol
SMILES c1c(c(ccc1)\C([Se]C(F)(F)F)=C/S(=O)(=O)c1ccc(cc1)C)Cl
SPLASH splash10-0a4l-7860900000-94df0c7381c5d8d090e9
Source of Spectrum BJO-13-SM29-3e
Wiley ID 1848302