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2,2-bis(2,5-dimethoxybenzyl)malonic acid diethyl ester
SpectraBase Compound ID AlIBKH9MJYE
InChI InChI=1S/C25H32O8/c1-7-32-23(26)25(24(27)33-8-2,15-17-13-19(28-3)9-11-21(17)30-5)16-18-14-20(29-4)10-12-22(18)31-6/h9-14H,7-8,15-16H2,1-6H3
InChIKey OYIQPMDCNFFOFX-UHFFFAOYSA-N
Mol Weight 460.5 g/mol
Molecular Formula C25H32O8
Exact Mass 460.209718 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KW0VvlzxJzk
Name 2,2-bis(2,5-dimethoxybenzyl)malonic acid diethyl ester
Alternate Name(s) 2,2-bis[(2,5-dimethoxyphenyl)methyl]propanedioic acid diethyl ester diethyl 2,2-bis[(2,5-dimethoxyphenyl)methyl]propanedioate
Comments Removed - expert review: contamination (CH2Cl2); A corrected record has been addded having SpectrumID: 1821169
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H32O8
InChI InChI=1S/C25H32O8/c1-7-32-23(26)25(24(27)33-8-2,15-17-13-19(28-3)9-11-21(17)30-5)16-18-14-20(29-4)10-12-22(18)31-6/h9-14H,7-8,15-16H2,1-6H3
InChIKey OYIQPMDCNFFOFX-UHFFFAOYSA-N
Molecular Weight 460.523 g/mol
SMILES C(Cc1c(ccc(c1)OC)OC)(Cc1c(ccc(c1)OC)OC)(C(=O)OCC)C(=O)OCC
SPLASH splash10-000t-9000000000-788a827b1d500ef61699
Source of Spectrum J-64-8205-0
Wiley ID 1531364