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2-Ethyl-4,7-diketo-caprylic acid methyl ester
SpectraBase Compound ID CjUgSN079Jc
InChI InChI=1S/C11H18O4/c1-4-9(11(14)15-3)7-10(13)6-5-8(2)12/h9H,4-7H2,1-3H3
InChIKey PFXWTJHJWFZKJK-UHFFFAOYSA-N
Mol Weight 214.26 g/mol
Molecular Formula C11H18O4
Exact Mass 214.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9gYr8w3wfNC
Name 4,7-DIONE-2-ETHYLOCTANOIC ACID, METHYL ESTER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C11H18O4
InChI InChI=1S/C11H18O4/c1-4-9(11(14)15-3)7-10(13)6-5-8(2)12/h9H,4-7H2,1-3H3
InChIKey PFXWTJHJWFZKJK-UHFFFAOYSA-N
Molecular Weight 214.1200
SMILES CC(CCC(CC(C(OC)=O)CC)=O)=O
SPLASH splash10-06xy-9300000000-7b3d038bb34dd3dcca3d
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany