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2-[4(e)-Formylcyclohex-(e)-yl]-5,6-dimethoxy-3-methyl-1,4-benzoquinone
SpectraBase Compound ID IFmDNPr1J9u
InChI InChI=1S/C16H20O5/c1-9-12(11-6-4-10(8-17)5-7-11)14(19)16(21-3)15(20-2)13(9)18/h8,10-11H,4-7H2,1-3H3/t10-,11-
InChIKey VBQSHSWQUBXFHD-UHFFFAOYSA-N
Mol Weight 292.33 g/mol
Molecular Formula C16H20O5
Exact Mass 292.131074 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1aYeBMBwkyt
Name 2-[4(e)-Formylcyclohex-(e)-yl]-5,6-dimethoxy-3-methyl-1,4-benzoquinone
Comments Less than 3 mono-isotopic peaks
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Formula C16H20O5
InChI InChI=1S/C16H20O5/c1-9-12(11-6-4-10(8-17)5-7-11)14(19)16(21-3)15(20-2)13(9)18/h8,10-11H,4-7H2,1-3H3/t10-,11-
InChIKey VBQSHSWQUBXFHD-UHFFFAOYSA-N
Molecular Weight 292.331 g/mol
SMILES C1(=C(C(=O)C(=C(C1=O)[C@]1(CC[C@](C=O)(CC1)[H])[H])C)OC)OC
SPLASH splash10-0006-0090000000-3bbcc4e4f703ed0192d5
Source of Spectrum J-62-8676-31
Synonyms 2-[4(a)-Formylcyclohex-(e)-yl]-5,6-dimethoxy-3-methyl-1,4-benzoquinone 4-(4,5-dimethoxy-2-methyl-3,6-dioxo-1,4-cyclohexadien-1-yl)cyclohexanecarbaldehyde
Wiley ID 1295418