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1-Iodo-1-chloro-3-phenylbut-2-yl acetate
SpectraBase Compound ID K94nUMT9jUJ
InChI InChI=1S/C12H14ClIO2/c1-8(10-6-4-3-5-7-10)11(12(13)14)16-9(2)15/h3-8,11-12H,1-2H3
InChIKey WGGVEJLRSMBKFM-UHFFFAOYSA-N
Mol Weight 352.6 g/mol
Molecular Formula C12H14ClIO2
Exact Mass 351.972702 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6Tt0viFNBJl
Name 1-Iodo-1-chloro-3-phenylbut-2-yl acetate
Alternate Name(s) Acetic acid (1-chloro-1-iodo-3-phenylbutan-2-yl) ester (1-chloro-1-iodo-3-phenylbutan-2-yl) acetate [1-[chloro(iodo)methyl]-2-phenyl-propyl] acetate (1-chloranyl-1-iodanyl-3-phenyl-butan-2-yl) ethanoate
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Formula C12H14ClIO2
InChI InChI=1S/C12H14ClIO2/c1-8(10-6-4-3-5-7-10)11(12(13)14)16-9(2)15/h3-8,11-12H,1-2H3
InChIKey WGGVEJLRSMBKFM-UHFFFAOYSA-N
Molecular Weight 352.599 g/mol
SMILES C(C(c1ccccc1)C)(OC(=O)C)C(Cl)I
SPLASH splash10-0aou-3910000000-4530926857073599c925
Source of Spectrum K1-2002-1845-4n
Wiley ID 872358