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2-Trichloromethyl 4-oxo-[1,3-b]-naphthodioxane
SpectraBase Compound ID AV52GaXiIT7
InChI InChI=1S/C13H7Cl3O3/c14-13(15,16)12-18-10-6-8-4-2-1-3-7(8)5-9(10)11(17)19-12/h1-6,12H
InChIKey GPUULCCTGOZXDE-UHFFFAOYSA-N
Mol Weight 317.56 g/mol
Molecular Formula C13H7Cl3O3
Exact Mass 315.946077 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BDpMTqFm26Z
Name 2-Trichloromethyl 4-oxo-[1,3-b]-naphthodioxane
Appearance Pale yellow crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 315.946077182 u
Formula C13H7Cl3O3
InChI InChI=1S/C13H7Cl3O3/c14-13(15,16)12-18-10-6-8-4-2-1-3-7(8)5-9(10)11(17)19-12/h1-6,12H
InChIKey GPUULCCTGOZXDE-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 317.555 g/mol
Quality 384
SMILES C1=CC2=C(C=C1)C=C1C(=C2)C(OC(O1)C(Cl)(Cl)Cl)=O
SPLASH splash10-03kc-1900000000-68707528552e3685c8c4
Source of Spectrum ARK-2001-101-5f (DOI: 10.3998/ark.5550190.0002.810)
Thin-Layer Chromatography 0.30
Wiley ID 1908899