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2-[(2E,6E,10E,14E,18E,22E)-3,7,11,15,19,23,27-heptamethyloctacosa-2,6,10,14,18,22,26-heptaenyl]-1,4-benzoquinone
SpectraBase Compound ID 2xQHb26NdPp
InChI InChI=1S/C41H60O2/c1-32(2)15-9-16-33(3)17-10-18-34(4)19-11-20-35(5)21-12-22-36(6)23-13-24-37(7)25-14-26-38(8)27-28-39-31-40(42)29-30-41(39)43/h15,17,19,21,23,25,27,29-31H,9-14,16,18,20,22,24,26,28H2,1-8H3/b33-17+,34-19+,35-21+,36-23+,37-25+,38-27+
InChIKey FLUHYUVEOJUODC-PYHSYOTJSA-N
Mol Weight 584.9 g/mol
Molecular Formula C41H60O2
Exact Mass 584.459331 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9k5PP8aBzPV
Name 2-[(2E,6E,10E,14E,18E,22E)-3,7,11,15,19,23,27-heptamethyloctacosa-2,6,10,14,18,22,26-heptaenyl]-1,4-benzoquinone
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Formula C41H60O2
InChI InChI=1S/C41H60O2/c1-32(2)15-9-16-33(3)17-10-18-34(4)19-11-20-35(5)21-12-22-36(6)23-13-24-37(7)25-14-26-38(8)27-28-39-31-40(42)29-30-41(39)43/h15,17,19,21,23,25,27,29-31H,9-14,16,18,20,22,24,26,28H2,1-8H3/b33-17+,34-19+,35-21+,36-23+,37-25+,38-27+
InChIKey FLUHYUVEOJUODC-PYHSYOTJSA-N
Molecular Weight 584.929 g/mol
SMILES C1(=CC(=O)C=CC1=O)C\C=C\(CC\C=C\(CC\C=C\(CC\C=C\(CC\C=C\(CC\C=C\(CCC=C(C)C)C)C)C)C)C)C
SPLASH splash10-03yi-8900000000-705e9f5014dff8111b93
Source of Spectrum AC-134-82-7
Synonyms 2-[(2E,6E,10E,14E,18E,22E)-3,7,11,15,19,23,27-heptamethyloctacosa-2,6,10,14,18,22,26-heptaenyl]-p-benzoquinone 2-[(2E,6E,10E,14E,18E,22E)-3,7,11,15,19,23,27-heptamethyloctacosa-2,6,10,14,18,22,26-heptaenyl]cyclohexa-2,5-diene-1,4-dione
Wiley ID 812435