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2-(3-bromophenyl)-2-oxoethyl 3-phenylpropiolate
SpectraBase Compound ID EoIfZLumS2R
InChI InChI=1S/C17H11BrO3/c18-15-8-4-7-14(11-15)16(19)12-21-17(20)10-9-13-5-2-1-3-6-13/h1-8,11H,12H2
InChIKey YGLPJJXUIKIFEG-UHFFFAOYSA-N
Mol Weight 343.18 g/mol
Molecular Formula C17H11BrO3
Exact Mass 341.989157 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KLiGoBybEik
Name 2-(3-bromophenyl)-2-oxoethyl 3-phenylpropiolate
Alternate Name(s) 3-Phenyl-2-propynoic acid [2-(3-bromophenyl)-2-oxoethyl] ester [2-(3-bromophenyl)-2-oxoethyl] 3-phenylprop-2-ynoate [2-(3-bromophenyl)-2-oxo-ethyl] 3-phenylprop-2-ynoate [2-(3-bromophenyl)-2-oxidanylidene-ethyl] 3-phenylprop-2-ynoate
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Formula C17H11BrO3
InChI InChI=1S/C17H11BrO3/c18-15-8-4-7-14(11-15)16(19)12-21-17(20)10-9-13-5-2-1-3-6-13/h1-8,11H,12H2
InChIKey YGLPJJXUIKIFEG-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201000762
Molecular Weight 343.176 g/mol
SMILES C(C#Cc1ccccc1)(=O)OCC(=O)c1cc(ccc1)Br
SPLASH splash10-004i-0900000000-1af1bcca5f6acc2d937d
Source of Spectrum ASC-353-31/SM5-1e
Wiley ID 1764643