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Ethyl 4-acetyl-5-oxocyclooctanecarboxylate

View entire compound with spectra: 1 MS (GC)

Ethyl 4-acetyl-5-oxocyclooctanecarboxylate
SpectraBase Compound ID 1UG4KzIRwKe
InChI InChI=1S/C13H20O4/c1-3-17-13(16)10-5-4-6-12(15)11(8-7-10)9(2)14/h10-11H,3-8H2,1-2H3
InChIKey IVEHDCGZAFIMLO-UHFFFAOYSA-N
Mol Weight 240.3 g/mol
Molecular Formula C13H20O4
Exact Mass 240.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FXhNEAxB3Cn
Name Ethyl 4-acetyl-5-oxocyclooctanecarboxylate
CAS Registry Number 116487-76-4
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O4
InChI InChI=1S/C13H20O4/c1-3-17-13(16)10-5-4-6-12(15)11(8-7-10)9(2)14/h10-11H,3-8H2,1-2H3
InChIKey IVEHDCGZAFIMLO-UHFFFAOYSA-N
Molecular Weight 240.299 g/mol
SMILES C1(C(=O)CCCC(C(=O)OCC)CC1)C(=O)C
SPLASH splash10-0002-0900000000-27ffd386c475ceafad32
Source of Spectrum J-55-824-4
Synonyms 4-Acetyl-5-keto-cyclooctanecarboxylic acid ethyl ester 4-Acetyl-5-oxo-1-cyclooctanecarboxylic acid ethyl ester Ethyl 4-acetyl-5-oxocyclooctane-1-carboxylate Ethyl 4-ethanoyl-5-oxidanylidene-cyclooctane-1-carboxylate
Wiley ID 1242869