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Diethyl 1,2-diphenylhexylmalonate
SpectraBase Compound ID CSiyDvG0hZ8
InChI InChI=1S/C25H32O4/c1-4-7-18-21(19-14-10-8-11-15-19)22(20-16-12-9-13-17-20)23(24(26)28-5-2)25(27)29-6-3/h8-17,21-23H,4-7,18H2,1-3H3
InChIKey MPBDTYWDXVLWAX-UHFFFAOYSA-N
Mol Weight 396.5 g/mol
Molecular Formula C25H32O4
Exact Mass 396.23006 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B3053CB3xNg
Name Diethyl 1,2-diphenylhexylmalonate
Alternate Name(s) Diethyl 2-(1,2-diphenylhexyl)malonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H32O4
InChI InChI=1S/C25H32O4/c1-4-7-18-21(19-14-10-8-11-15-19)22(20-16-12-9-13-17-20)23(24(26)28-5-2)25(27)29-6-3/h8-17,21-23H,4-7,18H2,1-3H3
InChIKey MPBDTYWDXVLWAX-UHFFFAOYSA-N
Molecular Weight 396.527 g/mol
SMILES C(C(C(c1ccccc1)CCCC)c1ccccc1)(C(=O)OCC)C(=O)OCC
SPLASH splash10-0007-9430000000-c62e2bf04884d004870f
Source of Spectrum SO-0-71-3
Wiley ID 872868