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Dodecanoic acid, isooctyl ester
SpectraBase Compound ID Lu4syIfaI9D
InChI InChI=1S/C20H40O2/c1-4-7-9-10-11-12-13-14-15-18-20(21)22-19(16-6-3)17-8-5-2/h19H,4-18H2,1-3H3
InChIKey DUWYUSJOTYPYQG-UHFFFAOYSA-N
Mol Weight 312.5 g/mol
Molecular Formula C20H40O2
Exact Mass 312.302831 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 55gg9DKtUyw
Name LAURIC ACID, 4-OCTYL ESTER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C20H40O2
InChI InChI=1S/C20H40O2/c1-4-7-9-10-11-12-13-14-15-18-20(21)22-19(16-6-3)17-8-5-2/h19H,4-18H2,1-3H3
InChIKey DUWYUSJOTYPYQG-UHFFFAOYSA-N
Molecular Weight 312.3018
SMILES CCCCCCCCCCCC(OC(CCC)CCCC)=O
SPLASH splash10-059x-9200000000-20a7cdc088ceca20e37d
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany