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3-Acetyloxyplumbagin

View entire compound with spectra: 1 MS (GC)

3-Acetyloxyplumbagin
SpectraBase Compound ID BIHwR7RRkPW
InChI InChI=1S/C13H10O5/c1-6-11(16)8-4-3-5-9(15)10(8)12(17)13(6)18-7(2)14/h3-5,15H,1-2H3
InChIKey BZLJEWNTOQFEOS-UHFFFAOYSA-N
Mol Weight 246.22 g/mol
Molecular Formula C13H10O5
Exact Mass 246.052823 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KwYWzwZcCtI
Name 3-Acetyloxyplumbagin
Alternate Name(s) Acetic acid (8-hydroxy-3-methyl-1,4-dioxo-2-naphthalenyl) ester (8-hydroxy-3-methyl-1,4-dioxonaphthalen-2-yl) acetate (8-hydroxy-3-methyl-1,4-dioxo-2-naphthyl) acetate [3-methyl-8-oxidanyl-1,4-bis(oxidanylidene)naphthalen-2-yl] ethanoate
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Formula C13H10O5
InChI InChI=1S/C13H10O5/c1-6-11(16)8-4-3-5-9(15)10(8)12(17)13(6)18-7(2)14/h3-5,15H,1-2H3
InChIKey BZLJEWNTOQFEOS-UHFFFAOYSA-N
Molecular Weight 246.218 g/mol
SMILES Oc1c2C(C(=C(C(=O)c2ccc1)C)OC(=O)C)=O
SPLASH splash10-0udi-0390000000-58107897ec6618789ba0
Source of Spectrum E1-45-443-8
Wiley ID 1553708