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2-Bromo-1,1-difluoro-4-(4-methoxyphenyl)-1-methylthiobutane
SpectraBase Compound ID AJcizzFW9y4
InChI InChI=1S/C12H15BrF2OS/c1-16-10-6-3-9(4-7-10)5-8-11(13)12(14,15)17-2/h3-4,6-7,11H,5,8H2,1-2H3
InChIKey QZIZBOZVSXTHKC-UHFFFAOYSA-N
Mol Weight 325.21 g/mol
Molecular Formula C12H15BrF2OS
Exact Mass 323.999506 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1m6cXnlCHST
Name 2-Bromo-1,1-difluoro-4-(4-methoxyphenyl)-1-methylthiobutane
Alternate Name(s) 1-[3-bromo-4,4-difluoro-4-(methylsulfanyl)butyl]-4-methoxybenzene 4-[3-bromo-4,4-difluoro-4-(methylsulfanyl)butyl]phenyl methyl ether
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Formula C12H15BrF2OS
InChI InChI=1S/C12H15BrF2OS/c1-16-10-6-3-9(4-7-10)5-8-11(13)12(14,15)17-2/h3-4,6-7,11H,5,8H2,1-2H3
InChIKey QZIZBOZVSXTHKC-UHFFFAOYSA-N
Molecular Weight 325.212 g/mol
SMILES C(C(CCc1ccc(cc1)OC)Br)(SC)(F)F
SPLASH splash10-00di-0903000000-bfac26206de1c3a8165f
Source of Spectrum AJ-71-1946-2
Wiley ID 774415