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Oxacycloheptadecane-2,13-dione
SpectraBase Compound ID 87IkFhWVEF5
InChI InChI=1S/C16H28O3/c17-15-11-7-5-3-1-2-4-6-8-13-16(18)19-14-10-9-12-15/h1-14H2
InChIKey BFRVMARKLHXDFW-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 1d75NelCghf
Name Oxacycloheptadecane-2,13-dione
CAS Registry Number 57785-41-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H28O3
InChI InChI=1S/C16H28O3/c17-15-11-7-5-3-1-2-4-6-8-13-16(18)19-14-10-9-12-15/h1-14H2
InChIKey BFRVMARKLHXDFW-UHFFFAOYSA-N
Molecular Weight 268.397 g/mol
SMILES C1(OCCCCC(=O)CCCCCCCCCC1)=O
SPLASH splash10-0aov-9200000000-3de136f1b503f0587c8b
Source of Spectrum H-69-1620-13
Synonyms 12-oxo-16-hexadecanolid
Wiley ID 1272408