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(2E,4E,6E,8E,10E,12E)-13-[(4R)-4-hydroxy-2,6,6-trimethyl-1-cyclohexenyl]-2,7,11-trimethyltrideca-2,4,6,8,10,12-hexaenal
SpectraBase Compound ID 747tr2N1xrx
InChI InChI=1S/C25H34O2/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/h7-15,18,23,27H,16-17H2,1-6H3/b8-7+,12-9+,15-14+,19-10+,20-13+,21-11+/t23-/m1/s1
InChIKey PAUIQDPAEDELMC-HEZGKBSMSA-N
Mol Weight 366.5 g/mol
Molecular Formula C25H34O2
Exact Mass 366.25588 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4TiwPjPRvZs
Name (2E,4E,6E,8E,10E,12E)-13-[(4R)-4-hydroxy-2,6,6-trimethyl-1-cyclohexenyl]-2,7,11-trimethyltrideca-2,4,6,8,10,12-hexaenal
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Formula C25H34O2
InChI InChI=1S/C25H34O2/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/h7-15,18,23,27H,16-17H2,1-6H3/b8-7+,12-9+,15-14+,19-10+,20-13+,21-11+/t23-/m1/s1
InChIKey PAUIQDPAEDELMC-HEZGKBSMSA-N
Molecular Weight 366.545 g/mol
SMILES O[C@]1(CC(C(=C(C1)C)\C=C\C(=C\C=C\C(=C\C=C\C=C\(C=O)C)C)C)(C)C)[H]
SPLASH splash10-014i-3907000000-2c481a71966c15cd627d
Source of Spectrum SB-48-902-6
Synonyms (2E,4E,6E,8E,10E,12E)-13-[(4R)-4-hydroxy-2,6,6-trimethyl-cyclohexen-1-yl]-2,7,11-trimethyl-trideca-2,4,6,8,10,12-hexaenal (2E,4E,6E,8E,10E,12E)-2,7,11-trimethyl-13-[(4R)-2,6,6-trimethyl-4-oxidanyl-cyclohexen-1-yl]trideca-2,4,6,8,10,12-hexaenal
Wiley ID 1352298