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5,6,8-trimethoxy-2-methyl-3-prop-2-ynyl-naphthalene-1,4-dione
SpectraBase Compound ID LcvFE8aUM9n
InChI InChI=1S/C17H16O5/c1-6-7-10-9(2)15(18)13-11(20-3)8-12(21-4)17(22-5)14(13)16(10)19/h1,8H,7H2,2-5H3
InChIKey ILQJYCVVLNBCMC-UHFFFAOYSA-N
Mol Weight 300.31 g/mol
Molecular Formula C17H16O5
Exact Mass 300.099774 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FCNjvMpbZaP
Name 5,6,8-trimethoxy-2-methyl-3-prop-2-ynyl-naphthalene-1,4-dione
Alternate Name(s) 5,6,8-trimethoxy-2-methyl-3-propargyl-1,4-naphthoquinone
Comments Less than 3 mono-isotopic peaks
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Formula C17H16O5
InChI InChI=1S/C17H16O5/c1-6-7-10-9(2)15(18)13-11(20-3)8-12(21-4)17(22-5)14(13)16(10)19/h1,8H,7H2,2-5H3
InChIKey ILQJYCVVLNBCMC-UHFFFAOYSA-N
Molecular Weight 300.310 g/mol
SMILES c12c(C(=O)C(=C(C2=O)C)CC#C)c(OC)c(cc1OC)OC
SPLASH splash10-0fb9-9006000000-7643fef082f34b83e62f
Source of Spectrum J-58-511-14
Wiley ID 1302906