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Succinic acid, 3,7-dimethyloct-6-en-1-yl tridecyl ester

View entire compound with spectra: 1 NMR

Succinic acid, 3,7-dimethyloct-6-en-1-yl tridecyl ester
SpectraBase Compound ID Cp3beakkzju
InChI InChI=1S/C27H50O4/c1-5-6-7-8-9-10-11-12-13-14-15-22-30-26(28)19-20-27(29)31-23-21-25(4)18-16-17-24(2)3/h17,25H,5-16,18-23H2,1-4H3
InChIKey HCHIMNRQNKQVQM-UHFFFAOYSA-N
Mol Weight 438.7 g/mol
Molecular Formula C27H50O4
Exact Mass 438.37091 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IKjWusXtvXO
Name Succinic acid, 3,7-dimethyloct-6-en-1-yl tridecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 438.370910086 u
Formula C27H50O4
InChI InChI=1S/C27H50O4/c1-5-6-7-8-9-10-11-12-13-14-15-22-30-26(28)19-20-27(29)31-23-21-25(4)18-16-17-24(2)3/h17,25H,5-16,18-23H2,1-4H3
InChIKey HCHIMNRQNKQVQM-UHFFFAOYSA-N
Molecular Weight 438.693 g/mol
SMILES CC(C)=CCCC(C)CCOC(CCC(OCCCCCCCCCCCCC)=O)=O