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7-(1,3-Dioxan-2-yl)-3-heptanone

View entire compound with spectra: 1 MS (GC)

7-(1,3-Dioxan-2-yl)-3-heptanone
SpectraBase Compound ID eTgeyA076E
InChI InChI=1S/C11H20O3/c1-2-10(12)6-3-4-7-11-13-8-5-9-14-11/h11H,2-9H2,1H3
InChIKey XQHRFOXMIYJXEG-UHFFFAOYSA-N
Mol Weight 200.28 g/mol
Molecular Formula C11H20O3
Exact Mass 200.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5SLWsynPeEq
Name 7-(1,3-Dioxan-2-yl)-3-heptanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H20O3
InChI InChI=1S/C11H20O3/c1-2-10(12)6-3-4-7-11-13-8-5-9-14-11/h11H,2-9H2,1H3
InChIKey XQHRFOXMIYJXEG-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo500464q
Molecular Weight 200.278 g/mol
SMILES C1COC(CCCCC(CC)=O)OC1
SPLASH splash10-052r-9200000000-e43989d7a4c023a44252
Source of Spectrum J-79-4005-3vh
Synonyms 7-(1,3-dioxan-2-yl)heptan-3-one
Wiley ID 1746248