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2-Anilino-3-(1,4-dioxan-2-yl)-1,4-naphthoquinone
SpectraBase Compound ID IPiILqZTdJU
InChI InChI=1S/C20H17NO4/c22-19-14-8-4-5-9-15(14)20(23)18(21-13-6-2-1-3-7-13)17(19)16-12-24-10-11-25-16/h1-9,16,21H,10-12H2
InChIKey BTGIFRSHDJUDFU-UHFFFAOYSA-N
Mol Weight 335.36 g/mol
Molecular Formula C20H17NO4
Exact Mass 335.115758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2pPk27nN9Ao
Name 2-Anilino-3-(1,4-dioxan-2-yl)-1,4-naphthoquinone
Alternate Name(s) 2-(1,4-dioxan-2-yl)-3-phenylazanyl-naphthalene-1,4-dione 2-anilino-3-(1,4-dioxan-2-yl)naphthalene-1,4-dione
Comments Less than 3 mono-isotopic peaks
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Formula C20H17NO4
InChI InChI=1S/C20H17NO4/c22-19-14-8-4-5-9-15(14)20(23)18(21-13-6-2-1-3-7-13)17(19)16-12-24-10-11-25-16/h1-9,16,21H,10-12H2
InChIKey BTGIFRSHDJUDFU-UHFFFAOYSA-N
Molecular Weight 335.359 g/mol
SMILES N(C1=C(C(c2c(cccc2)C1=O)=O)C1OCCOC1)c1ccccc1
SPLASH splash10-004r-0089000000-9e200b7c3a3ddb908f25
Source of Spectrum KC-0-1103-15
Wiley ID 781229