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Diethyl 2,2'-bis(.beta.-benzoylacetate)
SpectraBase Compound ID IgQS8ll0Hcv
InChI InChI=1S/C22H22O6/c1-3-27-21(25)17(19(23)15-11-7-5-8-12-15)18(22(26)28-4-2)20(24)16-13-9-6-10-14-16/h5-14,17-18H,3-4H2,1-2H3
InChIKey LNKDGSQQKJLYEV-UHFFFAOYSA-N
Mol Weight 382.41 g/mol
Molecular Formula C22H22O6
Exact Mass 382.141638 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FklYZUrhc1x
Name Diethyl 2,2'-bis(.beta.-benzoylacetate)
Alternate Name(s) 2,3-Dibenzoylbutanedioic acid diethyl ester 2,3-Dibenzoylsuccinic acid diethyl ester Diethyl 2,3-bis(phenylcarbonyl)butanedioate Diethyl 2,3-dibenzoylbutanedioate Diethyl 2,3-dibenzoylsuccinate
CAS Registry Number 4687-38-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H22O6
InChI InChI=1S/C22H22O6/c1-3-27-21(25)17(19(23)15-11-7-5-8-12-15)18(22(26)28-4-2)20(24)16-13-9-6-10-14-16/h5-14,17-18H,3-4H2,1-2H3
InChIKey LNKDGSQQKJLYEV-UHFFFAOYSA-N
Molecular Weight 382.412 g/mol
SMILES CCOC(C(C(C(c1ccccc1)=O)C(=O)OCC)C(c1ccccc1)=O)=O
SPLASH splash10-0a4i-0900000000-b69495494f3840ffab58
Source of Spectrum F-44-1606-4
Wiley ID 1360600