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Methyl 4-(3-bromo-2,2,3,3-tetrafluoropropyl)benzoate
SpectraBase Compound ID CMt5tyZ4DJX
InChI InChI=1S/C11H9BrF4O2/c1-18-9(17)8-4-2-7(3-5-8)6-10(13,14)11(12,15)16/h2-5H,6H2,1H3
InChIKey GRZHKYPVRBNVAZ-UHFFFAOYSA-N
Mol Weight 329.09 g/mol
Molecular Formula C11H9BrF4O2
Exact Mass 327.972205 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7TW8JrPLwP4
Name Methyl 4-(3-bromo-2,2,3,3-tetrafluoropropyl)benzoate
Alternate Name(s) 4-(3-bromo-2,2,3,3-tetrafluoropropyl)benzoic acid methyl ester Methyl 4-(3-bromo-2,2,3,3-tetrafluoro-propyl)benzoate Methyl 4-[3-bromanyl-2,2,3,3-tetrakis(fluoranyl)propyl]benzoate
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Formula C11H9BrF4O2
InChI InChI=1S/C11H9BrF4O2/c1-18-9(17)8-4-2-7(3-5-8)6-10(13,14)11(12,15)16/h2-5H,6H2,1H3
InChIKey GRZHKYPVRBNVAZ-UHFFFAOYSA-N
Molecular Weight 329.089 g/mol
SMILES c1(ccc(cc1)CC(C(Br)(F)F)(F)F)C(=O)OC
SPLASH splash10-0002-5961000000-6580729014cd4fd9b4eb
Source of Spectrum IY-1-4243-5
Wiley ID 1650436