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5,5-Dimethyl-2-pentyl-1,3-dioxane

View entire compound with spectra: 1 MS (GC)

5,5-Dimethyl-2-pentyl-1,3-dioxane
SpectraBase Compound ID 2utzaubwyLE
InChI InChI=1S/C11H22O2/c1-4-5-6-7-10-12-8-11(2,3)9-13-10/h10H,4-9H2,1-3H3
InChIKey CGNHGBLPANXVRL-UHFFFAOYSA-N
Mol Weight 186.29 g/mol
Molecular Formula C11H22O2
Exact Mass 186.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C27pBthSsAa
Name 5,5-Dimethyl-2-pentyl-1,3-dioxane
Appearance Colorless oil
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 186.161979946 u
Formula C11H22O2
InChI InChI=1S/C11H22O2/c1-4-5-6-7-10-12-8-11(2,3)9-13-10/h10H,4-9H2,1-3H3
InChIKey CGNHGBLPANXVRL-UHFFFAOYSA-N
Instrument Name HP 5890 GC-5989B MSD
Ionization Type EI
Literature Reference DOI 10.1002/chem.202300820
Molecular Weight 186.295 g/mol
Quality 176
SMILES CC1(COC(OC1)CCCCC)C
SPLASH splash10-014i-9700000000-54e92e13b7a61ed01215
Source of Spectrum QE-29-SM21-2ag (DOI: 10.1002/chem.202300820)
Thin-Layer Chromatography 0.48 (PE/EtOAc, 95:5)
Wiley ID 1910270