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1-Oxacyclododecan-2,8-dione

View entire compound with spectra: 5 MS (GC)

1-Oxacyclododecan-2,8-dione
SpectraBase Compound ID AKQUdAXFNSD
InChI InChI=1S/C11H18O3/c12-10-6-2-1-3-8-11(13)14-9-5-4-7-10/h1-9H2
InChIKey UXXMYQVAUQQYNE-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 D8lKBFZeLrf
Name 1-Oxacyclododecan-2,8-dione
CAS Registry Number 16121-14-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H18O3
InChI InChI=1S/C11H18O3/c12-10-6-2-1-3-8-11(13)14-9-5-4-7-10/h1-9H2
InChIKey UXXMYQVAUQQYNE-UHFFFAOYSA-N
Molecular Weight 198.262 g/mol
SMILES C1CCOC(CCCCCC(C1)=O)=O
SPLASH splash10-05mn-9200000000-c1207bd705c2e07adc65
Source of Spectrum CM-1999-10261-0
Synonyms Oxacyclododecane-2,8-dione 1-Oxacyclododecane-2,8-dione Oxacyclododecane-2,8-quinone
Wiley ID 472615