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Cyclododecanecarboxylic acid, 2-oxo-1-(3-oxobutyl)-, methyl ester
SpectraBase Compound ID 47JYCjDRJU7
InChI InChI=1S/C18H30O4/c1-15(19)12-14-18(17(21)22-2)13-10-8-6-4-3-5-7-9-11-16(18)20/h3-14H2,1-2H3
InChIKey KFXOMWCAGHUISJ-UHFFFAOYSA-N
Mol Weight 310.43 g/mol
Molecular Formula C18H30O4
Exact Mass 310.214409 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IZmMGtjd24P
Name Cyclododecanecarboxylic acid, 2-oxo-1-(3-oxobutyl)-, methyl ester
Alternate Name(s) Methyl 2-oxo-1-(3-oxobutyl)cyclododecanecarboxylate 2-Oxo-1-(3-oxobutyl)-1-cyclododecanecarboxylic acid methyl ester Methyl 2-oxo-1-(3-oxobutyl)cyclododecane-1-carboxylate Methyl 2-oxidanylidene-1-(3-oxidanylidenebutyl)cyclododecane-1-carboxylate
CAS Registry Number 62939-86-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H30O4
InChI InChI=1S/C18H30O4/c1-15(19)12-14-18(17(21)22-2)13-10-8-6-4-3-5-7-9-11-16(18)20/h3-14H2,1-2H3
InChIKey KFXOMWCAGHUISJ-UHFFFAOYSA-N
Molecular Weight 310.434 g/mol
SMILES C1(C(=O)OC)(C(=O)CCCCCCCCCC1)CCC(=O)C
SPLASH splash10-0006-9010000000-d9459c9b03d213cb0611
Source of Spectrum KC-1977-262-0
Wiley ID 1311645