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(5-oxidanylidenecyclohepta-1,3,6-trien-1-yl) ethanoate
SpectraBase Compound ID rBusF27oam
InChI InChI=1S/C9H8O3/c1-7(10)12-9-4-2-3-8(11)5-6-9/h2-6H,1H3
InChIKey IODZHLFSUXOXFU-UHFFFAOYSA-N
Mol Weight 164.16 g/mol
Molecular Formula C9H8O3
Exact Mass 164.047344 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HtUmtMAmh1v
Name (5-oxidanylidenecyclohepta-1,3,6-trien-1-yl) ethanoate
Alternate Name(s) (5-oxocyclohepta-1,3,6-trien-1-yl) acetate Acetic acid (5-ketocyclohepta-1,3,6-trien-1-yl) ester Acetic acid (5-oxo-1-cyclohepta-1,3,6-trienyl) ester
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Formula C9H8O3
InChI InChI=1S/C9H8O3/c1-7(10)12-9-4-2-3-8(11)5-6-9/h2-6H,1H3
InChIKey IODZHLFSUXOXFU-UHFFFAOYSA-N
Molecular Weight 164.160 g/mol
SMILES C=1(C=CC(=O)C=CC1)OC(=O)C
SPLASH splash10-0006-9200000000-2f7494b459eaf080805a
Source of Spectrum AJ-66-2779-5
Wiley ID 772271