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1-(1,3-dioxan-2-yl)-5-phenylpentan-3-one
SpectraBase Compound ID 7kuXtjw5gOd
InChI InChI=1S/C15H20O3/c16-14(8-7-13-5-2-1-3-6-13)9-10-15-17-11-4-12-18-15/h1-3,5-6,15H,4,7-12H2
InChIKey XEQFNYKXEXMKTG-UHFFFAOYSA-N
Mol Weight 248.32 g/mol
Molecular Formula C15H20O3
Exact Mass 248.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A1OtNSLDL8k
Name 1-(1,3-dioxan-2-yl)-5-phenylpentan-3-one
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H20O3
GC Column Agilent 190915-433UI (30 m x 250 microm, film thickness 0.25 micrometer)
GC Oven Program Oven temp 320oC
InChI InChI=1S/C15H20O3/c16-14(8-7-13-5-2-1-3-6-13)9-10-15-17-11-4-12-18-15/h1-3,5-6,15H,4,7-12H2
InChIKey XEQFNYKXEXMKTG-UHFFFAOYSA-N
Instrument Name Agilent 8890-5977B
Ionization Type EI
Literature Reference DOI 10.1002/chem.202202212
Molecular Weight 248.322 g/mol
Quality 74
SMILES C1(OCCCO1)CCC(CCC1=CC=CC=C1)=O
SPLASH splash10-0udi-0900000000-bd881b9de6569da4710c
Source of Spectrum QE-28-SM206-3bj (DOI: 10.1002/chem.202202212)
Thin-Layer Chromatography 0.45 (nHex/Et, 30:1)
Wiley ID 1902376