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2-(1,3-benzodioxol-5-yl)-2-keto-acetic acid ethyl ester
SpectraBase Compound ID Kz625G7d2mQ
InChI InChI=1S/C11H10O5/c1-2-14-11(13)10(12)7-3-4-8-9(5-7)16-6-15-8/h3-5H,2,6H2,1H3
InChIKey ZYJHZYNSHIMYJQ-UHFFFAOYSA-N
Mol Weight 222.2 g/mol
Molecular Formula C11H10O5
Exact Mass 222.052823 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K2nsy99v7eH
Name 2-(1,3-benzodioxol-5-yl)-2-keto-acetic acid ethyl ester
Alternate Name(s) 2-(1,3-benzodioxol-5-yl)-2-oxoacetic acid ethyl ester Ethyl 2-(1,3-benzodioxol-5-yl)-2-oxidanylidene-ethanoate Ethyl 2-(1,3-benzodioxol-5-yl)-2-oxo-acetate
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Formula C11H10O5
InChI InChI=1S/C11H10O5/c1-2-14-11(13)10(12)7-3-4-8-9(5-7)16-6-15-8/h3-5H,2,6H2,1H3
InChIKey ZYJHZYNSHIMYJQ-UHFFFAOYSA-N
Molecular Weight 222.196 g/mol
SMILES C(C(=O)c1cc2OCOc2cc1)(=O)OCC
SPLASH splash10-0002-0910000000-748eef4031b856dc047c
Source of Spectrum F4-0-2109-2
Wiley ID 1620034