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(1-(5-bromo-2-methoxyphenyl)-2,2,2-trifluoroethyl)(p-tolyl)sulfane
SpectraBase Compound ID EbCrJBZKxNL
InChI InChI=1S/C16H14BrF3OS/c1-10-3-6-12(7-4-10)22-15(16(18,19)20)13-9-11(17)5-8-14(13)21-2/h3-9,15H,1-2H3
InChIKey LTSUSMBLKWQNAA-UHFFFAOYSA-N
Mol Weight 391.25 g/mol
Molecular Formula C16H14BrF3OS
Exact Mass 389.990084 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5upA3nmcdmi
Name (1-(5-bromo-2-methoxyphenyl)-2,2,2-trifluoroethyl)(p-tolyl)sulfane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14BrF3OS
InChI InChI=1S/C16H14BrF3OS/c1-10-3-6-12(7-4-10)22-15(16(18,19)20)13-9-11(17)5-8-14(13)21-2/h3-9,15H,1-2H3
InChIKey LTSUSMBLKWQNAA-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/asia.202200190
Molecular Weight 391.246 g/mol
Reported Formula C16H14OF3SBr
SMILES c1(Br)ccc(c(c1)C(C(F)(F)F)Sc1ccc(cc1)C)OC
SPLASH splash10-05mo-0988000000-b7eb907790b92b0641db
Source of Spectrum CAJ-17-SM4-3ac
Wiley ID 1871420