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Benzoic acid, 4-(3-bromo-2,3,3-trifluoro-1-propenyl)-, ethyl ester
SpectraBase Compound ID 7esw5Rq3DD5
InChI InChI=1S/C12H10BrF3O2/c1-2-18-11(17)9-5-3-8(4-6-9)7-10(14)12(13,15)16/h3-7H,2H2,1H3/b10-7-
InChIKey AZFQMIPVBOOAKZ-YFHOEESVSA-N
Mol Weight 323.11 g/mol
Molecular Formula C12H10BrF3O2
Exact Mass 321.981627 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9j8CTmm0aoL
Name Benzoic acid, 4-(3-bromo-2,3,3-trifluoro-1-propenyl)-, ethyl ester
Alternate Name(s) Ethyl 4-(3-bromo-2,3,3-trifluoroprop-1-enyl)benzoate 4-[(Z)-3-bromo-2,3,3-trifluoroprop-1-enyl]benzoic acid ethyl ester Ethyl 4-[(Z)-3-bromo-2,3,3-trifluoroprop-1-enyl]benzoate Ethyl 4-[(Z)-3-bromo-2,3,3-trifluoro-prop-1-enyl]benzoate Ethyl 4-[(Z)-3-bromanyl-2,3,3-tris(fluoranyl)prop-1-enyl]benzoate
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Formula C12H10BrF3O2
InChI InChI=1S/C12H10BrF3O2/c1-2-18-11(17)9-5-3-8(4-6-9)7-10(14)12(13,15)16/h3-7H,2H2,1H3/b10-7-
InChIKey AZFQMIPVBOOAKZ-YFHOEESVSA-N
Molecular Weight 323.109 g/mol
SMILES c1(ccc(cc1)\C=C\(C(Br)(F)F)F)C(=O)OCC
SPLASH splash10-0udi-2910000000-dddfe903ae5c50e0751b
Source of Spectrum IY-1-4243-4
Wiley ID 1650435