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Ethyl 4-acetyl-5-oxocyclononanecarboxylate

View entire compound with spectra: 1 MS (GC)

Ethyl 4-acetyl-5-oxocyclononanecarboxylate
SpectraBase Compound ID 8vIJoDlFFtQ
InChI InChI=1S/C14H22O4/c1-3-18-14(17)11-6-4-5-7-13(16)12(9-8-11)10(2)15/h11-12H,3-9H2,1-2H3
InChIKey VQXUZZCKLMZCKB-UHFFFAOYSA-N
Mol Weight 254.33 g/mol
Molecular Formula C14H22O4
Exact Mass 254.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LohKcoxyLux
Name Ethyl 4-acetyl-5-oxocyclononanecarboxylate
CAS Registry Number 116487-77-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O4
InChI InChI=1S/C14H22O4/c1-3-18-14(17)11-6-4-5-7-13(16)12(9-8-11)10(2)15/h11-12H,3-9H2,1-2H3
InChIKey VQXUZZCKLMZCKB-UHFFFAOYSA-N
Molecular Weight 254.326 g/mol
SMILES C1(C(=O)CCCCC(C(=O)OCC)CC1)C(=O)C
SPLASH splash10-00di-0920000000-d8b05f35e97729768d84
Source of Spectrum J-55-824-5
Wiley ID 1257703