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2-Phenyl-4,5-dimethyl-1,3-dioxolan
SpectraBase Compound ID GpazUlCS4SP
InChI InChI=1S/C11H14O2/c1-8-9(2)13-11(12-8)10-6-4-3-5-7-10/h3-9,11H,1-2H3
InChIKey KELZBYQXUNVXEU-UHFFFAOYSA-N
Mol Weight 178.23 g/mol
Molecular Formula C11H14O2
Exact Mass 178.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G98aEUdhwPz
Name 4,5-Dimethyl-2-phenyl-1,3-dioxolane
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 178.099379689 u
Formula C11H14O2
InChI InChI=1S/C11H14O2/c1-8-9(2)13-11(12-8)10-6-4-3-5-7-10/h3-9,11H,1-2H3
InChIKey KELZBYQXUNVXEU-UHFFFAOYSA-N
Instrument Name HP 5890 GC-5989B MSD
Ionization Type EI
Literature Reference DOI 10.1002/chem.202300820
Molecular Weight 178.231 g/mol
Quality 152
SMILES CC1C(OC(O1)C1=CC=CC=C1)C
SPLASH splash10-004i-2900000000-230571bf4c3a5c6661c5
Sample Comments Major diastereomer, dr = 1.0:1.45:2.55
Source of Spectrum QE-29-SM11-2d (DOI: 10.1002/chem.202300820)
Thin-Layer Chromatography 0.55, 0.57, 0.60 (pentane/Et2O, 95:5)
Wiley ID 1910287