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VDDALGSXMJYSIM-MDWZMJQESA-N
SpectraBase Compound ID KdJ5vgBHDC1
InChI InChI=1S/C17H22O2/c1-12(2)6-5-7-13(3)8-9-15-11-16(18)10-14(4)17(15)19/h6,8,10-11H,5,7,9H2,1-4H3/b13-8+
InChIKey VDDALGSXMJYSIM-MDWZMJQESA-N
Mol Weight 258.36 g/mol
Molecular Formula C17H22O2
Exact Mass 258.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Rgc9hKOmZu
Name 2-(3',7'-Dimethylocta-2',6'-dienyl)-6-methyl-2,5-cyclohexadiene-1,4-dione
Alternate Name(s) 2-[(2E)-3,7-dimethylocta-2,6-dienyl]-6-methyl-1,4-benzoquinone 2-[(2E)-3,7-dimethylocta-2,6-dienyl]-6-methylcyclohexa-2,5-diene-1,4-dione 2-[(2E)-3,7-dimethylocta-2,6-dienyl]-6-methyl-p-benzoquinone 2-[(2E)-3,7-dimethylocta-2,6-dienyl]-6-methyl-cyclohexa-2,5-diene-1,4-dione
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Formula C17H22O2
InChI InChI=1S/C17H22O2/c1-12(2)6-5-7-13(3)8-9-15-11-16(18)10-14(4)17(15)19/h6,8,10-11H,5,7,9H2,1-4H3/b13-8+
InChIKey VDDALGSXMJYSIM-MDWZMJQESA-N
Molecular Weight 258.361 g/mol
SMILES C=1(C(C(C)=CC(C1)=O)=O)C\C=C\(CCC=C(C)C)C
SPLASH splash10-004i-2910000000-d604c80a67a13ee421c6
Source of Spectrum G4-70-674-7
Wiley ID 1694723