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2-(Pyren-2-yl)-1,3-dioxane
SpectraBase Compound ID FuT9H5hWfzQ
InChI InChI=1S/C20H16O2/c1-3-13-5-7-15-11-17(20-21-9-2-10-22-20)12-16-8-6-14(4-1)18(13)19(15)16/h1,3-8,11-12,20H,2,9-10H2
InChIKey LMPOIJMPKUEQMV-UHFFFAOYSA-N
Mol Weight 288.35 g/mol
Molecular Formula C20H16O2
Exact Mass 288.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3x5Kskxx6DD
Name 2-(Pyren-2-yl)-1,3-dioxane
Appearance Yellow solid
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 288.115029753 u
Formula C20H16O2
InChI InChI=1S/C20H16O2/c1-3-13-5-7-15-11-17(20-21-9-2-10-22-20)12-16-8-6-14(4-1)18(13)19(15)16/h1,3-8,11-12,20H,2,9-10H2
InChIKey LMPOIJMPKUEQMV-UHFFFAOYSA-N
Instrument Name HP 5890 GC-5989B MSD
Ionization Type EI
Literature Reference DOI 10.1002/chem.202300820
Reported Formula C20H16O2
SMILES C=12C3=C4C(C=C2)=CC=CC4=CC=C3C=C(C1)C1OCCCO1
SPLASH splash10-0udi-0090000000-c9f649d7e39547fb4624
Source of Spectrum QE-29-SM20-2ac (DOI: 10.1002/chem.202300820)
Thin-Layer Chromatography 0.32 (PE/EtOAc, 9:1)
Wiley ID 1910267