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2,2-Dihexylmalonic acid, diethyl ester
SpectraBase Compound ID D9ZGWu6lfhJ
InChI InChI=1S/C19H36O4/c1-5-9-11-13-15-19(17(20)22-7-3,18(21)23-8-4)16-14-12-10-6-2/h5-16H2,1-4H3
InChIKey PWSLBMVNVSADMI-UHFFFAOYSA-N
Mol Weight 328.5 g/mol
Molecular Formula C19H36O4
Exact Mass 328.26136 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BIfvERWHigA
Name 2,2-DIHEXYLMALONIC ACID, DIETHYL ESTER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C19H36O4
InChI InChI=1S/C19H36O4/c1-5-9-11-13-15-19(17(20)22-7-3,18(21)23-8-4)16-14-12-10-6-2/h5-16H2,1-4H3
InChIKey PWSLBMVNVSADMI-UHFFFAOYSA-N
Molecular Weight 328.2604
SMILES C(OC(C(CCCCCC)(CCCCCC)C(OCC)=O)=O)C
SPLASH splash10-00di-5920000000-f9291dafd04ea15b28d0
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany