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Succinic acid, dodec-2-en-1-yl 2,2,3,3,4,4,5,5-octafluoropentyl ester

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Succinic acid, dodec-2-en-1-yl 2,2,3,3,4,4,5,5-octafluoropentyl ester
SpectraBase Compound ID IcTqTAkmNAQ
InChI InChI=1S/C21H30F8O4/c1-2-3-4-5-6-7-8-9-10-11-14-32-16(30)12-13-17(31)33-15-19(24,25)21(28,29)20(26,27)18(22)23/h10-11,18H,2-9,12-15H2,1H3/b11-10+
InChIKey YBCYTKKSIOPIAB-ZHACJKMWSA-N
Mol Weight 498.45 g/mol
Molecular Formula C21H30F8O4
Exact Mass 498.201635 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 77VnkmVq8kT
Name Succinic acid, dodec-2-en-1-yl 2,2,3,3,4,4,5,5-octafluoropentyl ester
Comments Computed using HOSE algorithm
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Exact Mass 498.201634746 u
Formula C21H30F8O4
InChI InChI=1S/C21H30F8O4/c1-2-3-4-5-6-7-8-9-10-11-14-32-16(30)12-13-17(31)33-15-19(24,25)21(28,29)20(26,27)18(22)23/h10-11,18H,2-9,12-15H2,1H3/b11-10+
InChIKey YBCYTKKSIOPIAB-ZHACJKMWSA-N
Molecular Weight 498.454 g/mol
SMILES C(CC(OC\C=C\CCCCCCCCC)=O)C(OCC(C(C(C(F)F)(F)F)(F)F)(F)F)=O