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4, 8-dimethyl dodeca-7Z-en-yl-9'.alpha., 10'.alpha.-dihydroxyundecan-1'-oate
SpectraBase Compound ID 6LVouyEuVVT
InChI InChI=1S/C26H50O4/c1-5-6-15-22(2)16-14-17-23(3)19-20-26(29)30-21-13-11-9-7-8-10-12-18-25(28)24(4)27/h16,23-25,27-28H,5-15,17-21H2,1-4H3/b22-16+/t23-,24+,25+/m0/s1
InChIKey GDVYHBLXCAPRHY-OVUJNZRKSA-N
Mol Weight 426.7 g/mol
Molecular Formula C26H50O4
Exact Mass 426.37091 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2Bn762Pr9c
Name 4, 8-dimethyl dodeca-7Z-en-yl-9'.alpha., 10'.alpha.-dihydroxyundecan-1'-oate
Alternate Name(s) Plucheasesquiterpenyl ester (S,E)-(10R,11R)-10,11-dihydroxydodecyl 4,8-dimethyldodec-7-enoate
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Formula C26H50O4
InChI InChI=1S/C26H50O4/c1-5-6-15-22(2)16-14-17-23(3)19-20-26(29)30-21-13-11-9-7-8-10-12-18-25(28)24(4)27/h16,23-25,27-28H,5-15,17-21H2,1-4H3/b22-16+/t23-,24+,25+/m0/s1
InChIKey GDVYHBLXCAPRHY-OVUJNZRKSA-N
Molecular Weight 426.682 g/mol
SMILES O[C@@]([C@@](CCCCCCCCCOC(CC[C@@](C)(CC\C=C/(C)CCCC)[H])=O)(O)[H])(C)[H]
SPLASH splash10-0c0v-9410000000-febe348c52ee49a3e3ba
Source of Spectrum Y1-40B-704-2
Wiley ID 1744075