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1-Benzyl-1-fluoro-2-phenylethyl p-tolyl sulfoxide
SpectraBase Compound ID ByTfPVchWH6
InChI InChI=1S/C22H21FOS/c1-18-12-14-21(15-13-18)25(24)22(23,16-19-8-4-2-5-9-19)17-20-10-6-3-7-11-20/h2-15H,16-17H2,1H3
InChIKey HXUQPAOJTWYGRL-UHFFFAOYSA-N
Mol Weight 352.47 g/mol
Molecular Formula C22H21FOS
Exact Mass 352.129715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID InvmIWMJbTc
Name 1-Benzyl-1-fluoro-2-phenylethyl p-tolyl sulfoxide
Comments Less than 3 mono-isotopic peaks
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Formula C22H21FOS
InChI InChI=1S/C22H21FOS/c1-18-12-14-21(15-13-18)25(24)22(23,16-19-8-4-2-5-9-19)17-20-10-6-3-7-11-20/h2-15H,16-17H2,1H3
InChIKey HXUQPAOJTWYGRL-UHFFFAOYSA-N
Molecular Weight 352.467 g/mol
SMILES c1(S(=O)C(Cc2ccccc2)(F)Cc2ccccc2)ccc(cc1)C
SPLASH splash10-03di-0090000000-412b66df749151ccd3b2
Source of Spectrum F-52-2357-0
Synonyms 1-benzyl-1-fluoro-2-phenylethyl 4-methylphenyl sulfoxide 1-[(1-benzyl-1-fluoro-2-phenylethyl)sulfinyl]-4-methylbenzene
Wiley ID 795351