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Succinic acid, dodec-2-en-1-yl pentafluorophenyl ester

View entire compound with spectra: 1 NMR

Succinic acid, dodec-2-en-1-yl pentafluorophenyl ester
SpectraBase Compound ID 9Yph8f0MIK1
InChI InChI=1S/C22H27F5O4/c1-2-3-4-5-6-7-8-9-10-11-14-30-15(28)12-13-16(29)31-22-20(26)18(24)17(23)19(25)21(22)27/h10-11H,2-9,12-14H2,1H3/b11-10+
InChIKey MUWYEKYACVBWLP-ZHACJKMWSA-N
Mol Weight 450.45 g/mol
Molecular Formula C22H27F5O4
Exact Mass 450.18295 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID OUI2V0np4W
Name Succinic acid, dodec-2-en-1-yl pentafluorophenyl ester
Comments Computed using HOSE algorithm
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Exact Mass 450.182950160 u
Formula C22H27F5O4
InChI InChI=1S/C22H27F5O4/c1-2-3-4-5-6-7-8-9-10-11-14-30-15(28)12-13-16(29)31-22-20(26)18(24)17(23)19(25)21(22)27/h10-11H,2-9,12-14H2,1H3/b11-10+
InChIKey MUWYEKYACVBWLP-ZHACJKMWSA-N
Molecular Weight 450.446 g/mol
SMILES C(CC(OC\C=C\CCCCCCCCC)=O)C(OC1=C(C(=C(C(=C1F)F)F)F)F)=O