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Acetic acid, [5,6-dihydro-6-(4-bromophenyl)-3,5,5-trimethyl-2-oxo-2H-pyran-4-yl] ester
SpectraBase Compound ID LRp26Be8hYj
InChI InChI=1S/C16H17BrO4/c1-9-13(20-10(2)18)16(3,4)14(21-15(9)19)11-5-7-12(17)8-6-11/h5-8,14H,1-4H3
InChIKey ZLKYQUAPUXDCEQ-UHFFFAOYSA-N
Mol Weight 353.21 g/mol
Molecular Formula C16H17BrO4
Exact Mass 352.031022 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 14tl4uzOrIY
Name Acetic acid, [5,6-dihydro-6-(4-bromophenyl)-3,5,5-trimethyl-2-oxo-2H-pyran-4-yl] ester
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Formula C16H17BrO4
InChI InChI=1S/C16H17BrO4/c1-9-13(20-10(2)18)16(3,4)14(21-15(9)19)11-5-7-12(17)8-6-11/h5-8,14H,1-4H3
InChIKey ZLKYQUAPUXDCEQ-UHFFFAOYSA-N
Molecular Weight 353.212 g/mol
SMILES C1(=C(C(=O)OC(C1(C)C)c1ccc(cc1)Br)C)OC(=O)C
SPLASH splash10-002f-9800000000-54478d66c6f388090c0e
Source of Spectrum AD-0-2532-0
Synonyms 2-(4-Bromophenyl)-3,3,5-trimethyl-6-oxo-3,6-dihydro-2H-pyran-4-yl acetate Acetic acid [2-(4-bromophenyl)-3,3,5-trimethyl-6-oxo-2H-pyran-4-yl] ester [2-(4-bromophenyl)-3,3,5-trimethyl-6-oxo-2H-pyran-4-yl] acetate [2-(4-bromophenyl)-3,3,5-trimethyl-6-oxidanylidene-2H-pyran-4-yl] ethanoate
Wiley ID 1432600