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Cyclooctanecarboxylic acid, 5-oxo-, ethyl ester
SpectraBase Compound ID 6rmnvRWc9SG
InChI InChI=1S/C11H18O3/c1-2-14-11(13)9-5-3-7-10(12)8-4-6-9/h9H,2-8H2,1H3
InChIKey FJAACCXTIJMECI-UHFFFAOYSA-N
Mol Weight 198.26 g/mol
Molecular Formula C11H18O3
Exact Mass 198.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 42dQOUTNZ8O
Name Cyclooctanecarboxylic acid, 5-oxo-, ethyl ester
Alternate Name(s) Ethyl 2-oxo-1-propylcyclopentanecarboxylate Ethyl 5-oxocyclooctanecarboxylate
CAS Registry Number 122898-08-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H18O3
InChI InChI=1S/C11H18O3/c1-2-14-11(13)9-5-3-7-10(12)8-4-6-9/h9H,2-8H2,1H3
InChIKey FJAACCXTIJMECI-UHFFFAOYSA-N
Molecular Weight 198.262 g/mol
SMILES C(=O)(C1CCCC(=O)CCC1)OCC
SPLASH splash10-0fba-0900000000-9a81d7f0269fb2012479
Source of Spectrum F-45-86-24
Wiley ID 1195522