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4-Oxo-1,3-(b)-naphthodioxane
SpectraBase Compound ID LCW0a0EEkpt
InChI InChI=1S/C12H8O3/c13-12-10-5-8-3-1-2-4-9(8)6-11(10)14-7-15-12/h1-6H,7H2
InChIKey CEMMUDXSPFCPRP-UHFFFAOYSA-N
Mol Weight 200.19 g/mol
Molecular Formula C12H8O3
Exact Mass 200.047344 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AncYdWAyOUa
Name 4-Oxo-1,3-(b)-naphthodioxane
Appearance White crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 200.047344115 u
Formula C12H8O3
InChI InChI=1S/C12H8O3/c13-12-10-5-8-3-1-2-4-9(8)6-11(10)14-7-15-12/h1-6H,7H2
InChIKey CEMMUDXSPFCPRP-UHFFFAOYSA-N
Instrument Name VG micromass 70/70F or a VG TRIO-1
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0002.810
Molecular Weight 200.193 g/mol
Quality 147
SMILES C1=CC2=C(C=C1)C=C1C(=C2)C(OCO1)=O
SPLASH splash10-022c-0910000000-1c46999df1e1026e8e8a
Source of Spectrum ARK-2001-100-5a (DOI: 10.3998/ark.5550190.0002.810)
Thin-Layer Chromatography 0.84
Wiley ID 1908894