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(2,2,2-triphenylacetyl) 4-bromobenzoate

View entire compound with spectra: 1 MS (GC)

(2,2,2-triphenylacetyl) 4-bromobenzoate
SpectraBase Compound ID BgOubdks1pE
InChI InChI=1S/C27H19BrO3/c28-24-18-16-20(17-19-24)25(29)31-26(30)27(21-10-4-1-5-11-21,22-12-6-2-7-13-22)23-14-8-3-9-15-23/h1-19H
InChIKey BVTGBDWUEHQXFO-UHFFFAOYSA-N
Mol Weight 471.35 g/mol
Molecular Formula C27H19BrO3
Exact Mass 470.051757 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EhbKAkhcVfa
Name (2,2,2-triphenylacetyl) 4-bromobenzoate
Alternate Name(s) 2,2,2-triphenylethanoyl 4-bromanylbenzoate 4-Bromobenzoic acid (1-oxo-2,2,2-triphenylethyl) ester 4-Bromobenzoic acid (2,2,2-triphenylacetyl) ester
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Formula C27H19BrO3
InChI InChI=1S/C27H19BrO3/c28-24-18-16-20(17-19-24)25(29)31-26(30)27(21-10-4-1-5-11-21,22-12-6-2-7-13-22)23-14-8-3-9-15-23/h1-19H
InChIKey BVTGBDWUEHQXFO-UHFFFAOYSA-N
Molecular Weight 471.350 g/mol
SMILES C(OC(c1ccc(cc1)Br)=O)(C(c1ccccc1)(c1ccccc1)c1ccccc1)=O
SPLASH splash10-00au-3950100000-2aefebb9971bd45d1e52
Source of Spectrum J-58-2133-3
Wiley ID 1392853