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(1S,4aS,8aS)-2,5,5,9-Tetramethyl-1-{[5'-(dodecanoyl)pentanoyl]oxymethyl}-(octahydro)-naphthalene
SpectraBase Compound ID IkUoriwtnSJ
InChI InChI=1S/C33H58O3/c1-6-7-8-9-10-11-12-13-14-15-19-28(34)20-16-17-21-31(35)36-26-29-27(2)22-23-30-32(3,4)24-18-25-33(29,30)5/h22,29-30H,6-21,23-26H2,1-5H3/t29-,30-,33+/m0/s1
InChIKey IDEOKXRBQCNLQH-WSZLSEGOSA-N
Mol Weight 502.8 g/mol
Molecular Formula C33H58O3
Exact Mass 502.438596 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BmIEk0sIDQv
Name (1S,4aS,8aS)-2,5,5,9-Tetramethyl-1-{[5'-(dodecanoyl)pentanoyl]oxymethyl}-(octahydro)-naphthalene
Alternate Name(s) 2,5,5,9-Tetramethyl-1-{[5'-(dodecanoyl)pentanoyl]oxymethyl}-(octahydro)-naphthalene 6-Ketostearoyl-drimenol Drimenol Lactarinate) [(1S,4aS,8aS)-2,5,5,8a-tetramethyl-1,4,4a,5,6,7,8,8a-octahydro-1-naphthalenyl]methyl 6-oxooctadecanoate
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Formula C33H58O3
InChI InChI=1S/C33H58O3/c1-6-7-8-9-10-11-12-13-14-15-19-28(34)20-16-17-21-31(35)36-26-29-27(2)22-23-30-32(3,4)24-18-25-33(29,30)5/h22,29-30H,6-21,23-26H2,1-5H3/t29-,30-,33+/m0/s1
InChIKey IDEOKXRBQCNLQH-WSZLSEGOSA-N
Molecular Weight 502.824 g/mol
SMILES [C@]12([C@@](CC=C([C@@]2(COC(=O)CCCCC(=O)CCCCCCCCCCCC)[H])C)(C(C)(C)CCC1)[H])C
SPLASH splash10-0pb9-7930000000-832b8fc5bb9045e378bb
Source of Spectrum X2-57-909-6
Wiley ID 1605544