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

View entire compound with spectra: 1 NMR

Glutaric acid, dodec-2-en-1-yl pentafluorophenyl ester
SpectraBase Compound ID G5gw1lKca5K
InChI InChI=1S/C23H29F5O4/c1-2-3-4-5-6-7-8-9-10-11-15-31-16(29)13-12-14-17(30)32-23-21(27)19(25)18(24)20(26)22(23)28/h10-11H,2-9,12-15H2,1H3/b11-10+
InChIKey HSTHZLWWWGAVOC-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 IEJAuPqHyTG
Name Glutaric acid, dodec-2-en-1-yl pentafluorophenyl ester
Comments Computed using HOSE algorithm
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Exact Mass 464.198600225 u
Formula C23H29F5O4
InChI InChI=1S/C23H29F5O4/c1-2-3-4-5-6-7-8-9-10-11-15-31-16(29)13-12-14-17(30)32-23-21(27)19(25)18(24)20(26)22(23)28/h10-11H,2-9,12-15H2,1H3/b11-10+
InChIKey HSTHZLWWWGAVOC-ZHACJKMWSA-N
Molecular Weight 464.473 g/mol
SMILES C(CCC(OC\C=C\CCCCCCCCC)=O)C(OC1=C(C(=C(C(=C1F)F)F)F)F)=O