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[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl (2Z,6E,10E)-3,7,11,15-tetra(methyl)hexadeca-2,6,10,14-tetraenoate
SpectraBase Compound ID JQWL9YUh1V9
InChI InChI=1S/C26H42O4/c1-20(2)11-8-12-21(3)13-9-14-22(4)15-10-16-23(5)17-25(27)28-18-24-19-29-26(6,7)30-24/h11,13,15,17,24H,8-10,12,14,16,18-19H2,1-7H3/b21-13+,22-15+,23-17+/t24-/m1/s1/i5+1,23+1
InChIKey XMXVRWWXLIVKJO-BQFDTKNKSA-N
Mol Weight 420.6 g/mol
Molecular Formula C2413C2H42O4
Exact Mass 420.315019 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CIKDC598dGX
Name [(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl (2Z,6E,10E)-3,7,11,15-tetra(methyl)hexadeca-2,6,10,14-tetraenoate
Comments Original formula: C24[13C]2H42O4
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Formula C26H42O4
InChI InChI=1S/C26H42O4/c1-20(2)11-8-12-21(3)13-9-14-22(4)15-10-16-23(5)17-25(27)28-18-24-19-29-26(6,7)30-24/h11,13,15,17,24H,8-10,12,14,16,18-19H2,1-7H3/b21-13+,22-15+,23-17+/t24-/m1/s1/i5+1,23+1
InChIKey XMXVRWWXLIVKJO-BQFDTKNKSA-N
Molecular Weight 420.603 g/mol
SMILES [13CH3]\[13C](=C/C(OC[C@]1(OC(OC1)(C)C)[H])=O)CC\C=C\(CC\C=C\(CCC=C(C)C)C)C
SPLASH splash10-0a4r-0951300000-680ee8f7369ae5cee067
Source of Spectrum F-56-2509-4
Synonyms 2,2-Dimethyl-1,3-dioxolan-4-ylmethyl 3,20-13C2-E,E.E-geranylgeranoic acid ester
Wiley ID 856620