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5-Acetoxy-2-chloro-naphthalene-1,4-dione
SpectraBase Compound ID 9v3if2bksNA
InChI InChI=1S/C12H7ClO4/c1-6(14)17-10-4-2-3-7-11(10)9(15)5-8(13)12(7)16/h2-5H,1H3
InChIKey FFPUECGXFXVOHU-UHFFFAOYSA-N
Mol Weight 250.64 g/mol
Molecular Formula C12H7ClO4
Exact Mass 250.003286 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 14TCj3YfoiJ
Name 5-Acetoxy-2-chloro-naphthalene-1,4-dione
Alternate Name(s) 5-Acetoxy-2-chloronaphthalene-1,4-dione 6-Chloro-5,8-dioxo-5,8-dihydronaphthalen-1-yl acetate Acetic acid (6-chloro-5,8-dioxo-1-naphthalenyl) ester (6-chloro-5,8-dioxonaphthalen-1-yl) acetate (6-chloro-5,8-dioxo-1-naphthyl) acetate [6-chloranyl-5,8-bis(oxidanylidene)naphthalen-1-yl] ethanoate
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Formula C12H7ClO4
InChI InChI=1S/C12H7ClO4/c1-6(14)17-10-4-2-3-7-11(10)9(15)5-8(13)12(7)16/h2-5H,1H3
InChIKey FFPUECGXFXVOHU-UHFFFAOYSA-N
Molecular Weight 250.637 g/mol
SMILES c12C(C=C(C(c2cccc1OC(=O)C)=O)Cl)=O
SPLASH splash10-0pb9-1290000000-fbe4058d079446d31c7f
Source of Spectrum U1-2014-5324-2a
Wiley ID 1740918