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Methyl 3-(2-oxocyclododecyl)propanoate
SpectraBase Compound ID G5YmdldIRnM
InChI InChI=1S/C16H28O3/c1-19-16(18)13-12-14-10-8-6-4-2-3-5-7-9-11-15(14)17/h14H,2-13H2,1H3
InChIKey GPPQDAXBMZIPEV-UHFFFAOYSA-N
Mol Weight 268.4 g/mol
Molecular Formula C16H28O3
Exact Mass 268.203845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B0fowM2lJU8
Name Methyl 3-(2-oxocyclododecyl)propanoate
CAS Registry Number 22502-38-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H28O3
InChI InChI=1S/C16H28O3/c1-19-16(18)13-12-14-10-8-6-4-2-3-5-7-9-11-15(14)17/h14H,2-13H2,1H3
InChIKey GPPQDAXBMZIPEV-UHFFFAOYSA-N
Molecular Weight 268.397 g/mol
SMILES C1CCCCCCCC(=O)C(CCC(OC)=O)CC1
SPLASH splash10-0006-9720000000-b00f1805be4033c61e07
Source of Spectrum AD-0-2532-0
Synonyms 3-(2-ketocyclododecyl)propionic acid methyl ester 3-(2-oxocyclododecyl)propanoic acid methyl ester Methyl 3-(2-oxidanylidenecyclododecyl)propanoate Propanoic acid, 3-[2-oxo(cyclododecyl)]-, methyl ester
Wiley ID 1430824