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Succinic acid, tridecyl 2,2,2-trifluoroethyl ester
SpectraBase Compound ID EEGzxyGzDlW
InChI InChI=1S/C19H33F3O4/c1-2-3-4-5-6-7-8-9-10-11-12-15-25-17(23)13-14-18(24)26-16-19(20,21)22/h2-16H2,1H3
InChIKey CNYBSIBAQKKJMW-UHFFFAOYSA-N
Mol Weight 382.5 g/mol
Molecular Formula C19H33F3O4
Exact Mass 382.233094 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5HyRhHjFP2k
Name Succinic acid, tridecyl 2,2,2-trifluoroethyl ester
Comments Computed using HOSE algorithm
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Exact Mass 382.233094028 u
Formula C19H33F3O4
InChI InChI=1S/C19H33F3O4/c1-2-3-4-5-6-7-8-9-10-11-12-15-25-17(23)13-14-18(24)26-16-19(20,21)22/h2-16H2,1H3
InChIKey CNYBSIBAQKKJMW-UHFFFAOYSA-N
Molecular Weight 382.464 g/mol
SMILES C(OCC(F)(F)F)(=O)CCC(OCCCCCCCCCCCCC)=O