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

View entire compound with spectra: 1 NMR

Succinic acid, dodec-2-en-1-yl pentafluorobenzyl ester
SpectraBase Compound ID BJvIfHAeYE
InChI InChI=1S/C23H29F5O4/c1-2-3-4-5-6-7-8-9-10-11-14-31-17(29)12-13-18(30)32-15-16-19(24)21(26)23(28)22(27)20(16)25/h10-11H,2-9,12-15H2,1H3/b11-10+
InChIKey ADVARIWMOSRTDA-ZHACJKMWSA-N
Mol Weight 464.47 g/mol
Molecular Formula C23H29F5O4
Exact Mass 464.1986 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F86wAgIoPLl
Name Succinic acid, dodec-2-en-1-yl pentafluorobenzyl ester
Comments Computed using HOSE algorithm
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Exact Mass 464.198600225 u
Formula C23H29F5O4
InChI InChI=1S/C23H29F5O4/c1-2-3-4-5-6-7-8-9-10-11-14-31-17(29)12-13-18(30)32-15-16-19(24)21(26)23(28)22(27)20(16)25/h10-11H,2-9,12-15H2,1H3/b11-10+
InChIKey ADVARIWMOSRTDA-ZHACJKMWSA-N
Molecular Weight 464.473 g/mol
SMILES C(CC(OC\C=C\CCCCCCCCC)=O)C(OCC1=C(C(=C(C(=C1F)F)F)F)F)=O