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Succinic acid, decyl tetradec-11-enyl ester

View entire compound with spectra: 1 NMR

Succinic acid, decyl tetradec-11-enyl ester
SpectraBase Compound ID Agk2sNiLsUU
InChI InChI=1S/C28H52O4/c1-3-5-7-9-11-13-14-15-16-18-20-22-26-32-28(30)24-23-27(29)31-25-21-19-17-12-10-8-6-4-2/h5,7H,3-4,6,8-26H2,1-2H3/b7-5+
InChIKey XGZFKXZYNCRYOZ-FNORWQNLSA-N
Mol Weight 452.7 g/mol
Molecular Formula C28H52O4
Exact Mass 452.38656 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EDvsgOwSLVj
Name Succinic acid, decyl tetradec-11-enyl ester
Comments Computed using HOSE algorithm
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Exact Mass 452.386560150 u
Formula C28H52O4
InChI InChI=1S/C28H52O4/c1-3-5-7-9-11-13-14-15-16-18-20-22-26-32-28(30)24-23-27(29)31-25-21-19-17-12-10-8-6-4-2/h5,7H,3-4,6,8-26H2,1-2H3/b7-5+
InChIKey XGZFKXZYNCRYOZ-FNORWQNLSA-N
Molecular Weight 452.720 g/mol
SMILES CC\C=C\CCCCCCCCCCOC(CCC(OCCCCCCCCCC)=O)=O