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2-Bromo-benzoic acid 1-methyl-2-oxo-1-phenyl-propyl ester
SpectraBase Compound ID 3elbiG6E2Wg
InChI InChI=1S/C17H15BrO3/c1-12(19)17(2,13-8-4-3-5-9-13)21-16(20)14-10-6-7-11-15(14)18/h3-11H,1-2H3
InChIKey CZPHAAIPOGDFNK-UHFFFAOYSA-N
Mol Weight 347.21 g/mol
Molecular Formula C17H15BrO3
Exact Mass 346.020457 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1qux4P9Odqb
Name 2-Bromo-benzoic acid 1-methyl-2-oxo-1-phenyl-propyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H15BrO3
InChI InChI=1S/C17H15BrO3/c1-12(19)17(2,13-8-4-3-5-9-13)21-16(20)14-10-6-7-11-15(14)18/h3-11H,1-2H3
InChIKey CZPHAAIPOGDFNK-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.200800355
Molecular Weight 347.208 g/mol
SMILES C(c1c(cccc1)Br)(=O)OC(c1ccccc1)(C)C(=O)C
SPLASH splash10-001i-3900000000-c31a1108fcb624d48ada
Source of Spectrum ASC-350-2414/SM17-5n
Synonyms 3-Oxo-2-phenylbutan-2-yl 2-bromobenzoate
Wiley ID 1765805