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(2E,4E,6E,8E,10E)-13-[(4R)-4-hydroxy-2,6,6-trimethyl-1-cyclohexenyl]-2,7,11-trimethyltrideca-2,4,6,8,10-pentaen-12-ynal
SpectraBase Compound ID AoxpfjwvzEo
InChI InChI=1S/C25H32O2/c1-19(10-7-8-11-21(3)18-26)12-9-13-20(2)14-15-24-22(4)16-23(27)17-25(24,5)6/h7-13,18,23,27H,16-17H2,1-6H3/b8-7+,12-9+,19-10+,20-13+,21-11+/t23-/m1/s1
InChIKey LVGHTZYRRMARRH-FRYGKWBPSA-N
Mol Weight 364.5 g/mol
Molecular Formula C25H32O2
Exact Mass 364.24023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AyjL2GAcnnH
Name (2E,4E,6E,8E,10E)-13-[(4R)-4-hydroxy-2,6,6-trimethyl-1-cyclohexenyl]-2,7,11-trimethyltrideca-2,4,6,8,10-pentaen-12-ynal
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Formula C25H32O2
InChI InChI=1S/C25H32O2/c1-19(10-7-8-11-21(3)18-26)12-9-13-20(2)14-15-24-22(4)16-23(27)17-25(24,5)6/h7-13,18,23,27H,16-17H2,1-6H3/b8-7+,12-9+,19-10+,20-13+,21-11+/t23-/m1/s1
InChIKey LVGHTZYRRMARRH-FRYGKWBPSA-N
Molecular Weight 364.529 g/mol
SMILES O[C@]1(CC(C(C#C\C(=C\C=C\C(=C\C=C\C=C\(C=O)C)C)C)=C(C1)C)(C)C)[H]
SPLASH splash10-08fu-9416000000-d82417bb91f2f082d772
Source of Spectrum SB-48-903-12
Synonyms (2E,4E,6E,8E,10E)-13-[(4R)-4-hydroxy-2,6,6-trimethyl-cyclohexen-1-yl]-2,7,11-trimethyl-trideca-2,4,6,8,10-pentaen-12-ynal (2E,4E,6E,8E,10E)-2,7,11-trimethyl-13-[(4R)-2,6,6-trimethyl-4-oxidanyl-cyclohexen-1-yl]trideca-2,4,6,8,10-pentaen-12-ynal
Wiley ID 1351172