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1-methyl-4-[(1E)-2-[(trifluoromethyl)selanyl]dec-1-ene-1-sulfonyl]benzene
SpectraBase Compound ID 3xw3wjV0qYn
InChI InChI=1S/C18H25F3O2SSe/c1-3-4-5-6-7-8-9-17(25-18(19,20)21)14-24(22,23)16-12-10-15(2)11-13-16/h10-14H,3-9H2,1-2H3/b17-14+
InChIKey KXYXGNWYYBBPDJ-SAPNQHFASA-N
Mol Weight 441.42 g/mol
Molecular Formula C18H25F3O2SSe
Exact Mass 442.069258 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6PxR3PsL5Uw
Name 1-methyl-4-[(1E)-2-[(trifluoromethyl)selanyl]dec-1-ene-1-sulfonyl]benzene
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H25F3O2SSe
InChI InChI=1S/C18H25F3O2SSe/c1-3-4-5-6-7-8-9-17(25-18(19,20)21)14-24(22,23)16-12-10-15(2)11-13-16/h10-14H,3-9H2,1-2H3/b17-14+
InChIKey KXYXGNWYYBBPDJ-SAPNQHFASA-N
Instrument Name Agilent HP 5890-5973
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.13.260
Molecular Weight 441.423 g/mol
SMILES C(C\C([Se]C(F)(F)F)=C/S(=O)(=O)c1ccc(cc1)C)CCCCCC
SPLASH splash10-0536-9830000000-960c6d03c6e32e8e710d
Source of Spectrum BJO-13-SM47-3k
Wiley ID 1848307