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2-(Heptadec-8'-enyl)-3,6-dihydroxy-1,4-benzoquinone
SpectraBase Compound ID 3w6aZydJ7DA
InChI InChI=1S/C23H36O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-22(26)20(24)18-21(25)23(19)27/h9-10,18,24,27H,2-8,11-17H2,1H3/b10-9+
InChIKey JUSMPONINWOSBL-MDZDMXLPSA-N
Mol Weight 376.5 g/mol
Molecular Formula C23H36O4
Exact Mass 376.26136 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2tmTGkBKRAX
Name 2-(Heptadec-8'-enyl)-3,6-dihydroxy-1,4-benzoquinone
Alternate Name(s) 3-[(8E)-8-heptadecenyl]-2,5-dihydroxybenzo-1,4-quinone
Comments Less than 3 mono-isotopic peaks
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Formula C23H36O4
InChI InChI=1S/C23H36O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-22(26)20(24)18-21(25)23(19)27/h9-10,18,24,27H,2-8,11-17H2,1H3/b10-9+
InChIKey JUSMPONINWOSBL-MDZDMXLPSA-N
Molecular Weight 376.537 g/mol
SMILES OC=1C(C(=C(C(C1)=O)O)CCCCCCC\C=C\CCCCCCCC)=O
SPLASH splash10-0zfr-0901000000-35c2fb38a2482199ed9b
Source of Spectrum U1-1999-1054-2
Wiley ID 752920