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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 5EBHXuOYQob
Name 2-Ethyl-4,7-diketo-caprylic acid methyl ester
Alternate Name(s) 2-Ethyl-4,7-dioxo-octanoic acid,methyl ester Methyl 2-ethyl-4,7-bis(oxidanylidene)octanoate Methyl 2-ethyl-4,7-dioxo-octanoate 2-Ethyl-4,7-dioxooctanoic acid methyl ester
CAS Registry Number 20577-49-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. 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 214.261 g/mol
SMILES CC(=O)CCC(=O)CC(CC)C(=O)OC
SPLASH splash10-06xy-9300000000-3a1a30c62c1c321357a1
Wiley ID 1471218