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4-(5,5-Dimethyl-1,3-dioxan-2-yl)-2-methoxyphenol
SpectraBase Compound ID LEniVBkCJxe
InChI InChI=1S/C13H18O4/c1-13(2)7-16-12(17-8-13)9-4-5-10(14)11(6-9)15-3/h4-6,12,14H,7-8H2,1-3H3
InChIKey KXCNHCPPVWDCET-UHFFFAOYSA-N
Mol Weight 238.28 g/mol
Molecular Formula C13H18O4
Exact Mass 238.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8FjsPuypAAy
Name 4-(5,5-Dimethyl-1,3-dioxan-2-yl)-2-methoxyphenol
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 238.120509056 u
Formula C13H18O4
InChI InChI=1S/C13H18O4/c1-13(2)7-16-12(17-8-13)9-4-5-10(14)11(6-9)15-3/h4-6,12,14H,7-8H2,1-3H3
InChIKey KXCNHCPPVWDCET-UHFFFAOYSA-N
Instrument Name HP 5890 GC-5989B MSD
Ionization Type EI
Literature Reference DOI 10.1002/chem.202300820
Molecular Weight 238.283 g/mol
Quality 125
SMILES OC1=C(C=C(C2OCC(C)(CO2)C)C=C1)OC
SPLASH splash10-0udr-0950000000-8e7c70793bbc6a6eca00
Source of Spectrum QE-29-SM18-2x (DOI: 10.1002/chem.202300820)
Thin-Layer Chromatography 0.45 (PE/Et2O, 6:4)
Wiley ID 1910302