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Glutaric acid, 3-methylbut-2-yl farnesyl ester

View entire compound with spectra: 1 NMR, and 1 FTIR

Glutaric acid, 3-methylbut-2-yl farnesyl ester
SpectraBase Compound ID 5QXXNUAn0XD
InChI InChI=1S/C25H42O4/c1-19(2)11-8-12-21(5)13-9-14-22(6)17-18-28-24(26)15-10-16-25(27)29-23(7)20(3)4/h11,13,17,20,23H,8-10,12,14-16,18H2,1-7H3/b21-13+,22-17+
InChIKey WFGWWNNWRWLSDP-BRAPJGFWSA-N
Mol Weight 406.6 g/mol
Molecular Formula C25H42O4
Exact Mass 406.30831 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1Z2Hh7gZKoZ
Name Glutaric acid, 3-methylbut-2-yl farnesyl ester
Comments Computed using HOSE algorithm
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Exact Mass 406.308309828 u
Formula C25H42O4
InChI InChI=1S/C25H42O4/c1-19(2)11-8-12-21(5)13-9-14-22(6)17-18-28-24(26)15-10-16-25(27)29-23(7)20(3)4/h11,13,17,20,23H,8-10,12,14-16,18H2,1-7H3/b21-13+,22-17+
InChIKey WFGWWNNWRWLSDP-BRAPJGFWSA-N
Molecular Weight 406.607 g/mol
SMILES C(CCC(OC(C(C)C)C)=O)C(OC\C=C\(CC\C=C\(CCC=C(C)C)C)C)=O