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2-[bis(3-fluorophenyl)methyl]malonic acid diethyl ester
SpectraBase Compound ID 6CcjntH57yV
InChI InChI=1S/C20H20F2O4/c1-3-25-19(23)18(20(24)26-4-2)17(13-7-5-9-15(21)11-13)14-8-6-10-16(22)12-14/h5-12,17-18H,3-4H2,1-2H3
InChIKey YCPYXFUTBDRSGC-UHFFFAOYSA-N
Mol Weight 362.37 g/mol
Molecular Formula C20H20F2O4
Exact Mass 362.132965 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CgYYcNvhzHG
Name 2-[bis(3-fluorophenyl)methyl]malonic acid diethyl ester
Alternate Name(s) 2-[bis(3-fluorophenyl)methyl]propanedioic acid diethyl ester Diethyl 2-[bis(3-fluorophenyl)methyl]propanedioate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20F2O4
InChI InChI=1S/C20H20F2O4/c1-3-25-19(23)18(20(24)26-4-2)17(13-7-5-9-15(21)11-13)14-8-6-10-16(22)12-14/h5-12,17-18H,3-4H2,1-2H3
InChIKey YCPYXFUTBDRSGC-UHFFFAOYSA-N
Molecular Weight 362.373 g/mol
SMILES C(C(c1cc(F)ccc1)c1cc(F)ccc1)(C(=O)OCC)C(=O)OCC
SPLASH splash10-0udi-0390000000-b0c05002b3d008f0b200
Source of Spectrum SK-29-347-3
Wiley ID 880352