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Bicyclo[3.1.0]hexane-6,6-dicarboxylic acid, 2-oxo-, diethyl ester
SpectraBase Compound ID AFyWQE26vHS
InChI InChI=1S/C12H16O5/c1-3-16-10(14)12(11(15)17-4-2)7-5-6-8(13)9(7)12/h7,9H,3-6H2,1-2H3
InChIKey DSHJXUTXEFBIHK-UHFFFAOYSA-N
Mol Weight 240.25 g/mol
Molecular Formula C12H16O5
Exact Mass 240.099774 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8Lctn9SW3mH
Name Bicyclo[3.1.0]hexane-6,6-dicarboxylic acid, 2-oxo-, diethyl ester
Alternate Name(s) 6,6-Diethoxycarbonyl-bicyclo(3,1,0)hexan-2-one Bicyclo[3.1.0]-6,6-dicarboethoxyhexan-2-one Diethyl 2-oxobicyclo[3.1.0]hexane-6,6-dicarboxylate
CAS Registry Number 125117-20-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O5
InChI InChI=1S/C12H16O5/c1-3-16-10(14)12(11(15)17-4-2)7-5-6-8(13)9(7)12/h7,9H,3-6H2,1-2H3
InChIKey DSHJXUTXEFBIHK-UHFFFAOYSA-N
Molecular Weight 240.255 g/mol
SMILES C1(C2C(=O)CCC12)(C(=O)OCC)C(=O)OCC
SPLASH splash10-014i-0910000000-feab7e25e90da8b553df
Source of Spectrum F-45-3017-7
Wiley ID 1242662