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Glutaric acid, naphth-2-ylmethyl pentafluorophenyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, naphth-2-ylmethyl pentafluorophenyl ester
SpectraBase Compound ID 69sBgTGgFs1
InChI InChI=1S/C22H15F5O4/c23-17-18(24)20(26)22(21(27)19(17)25)31-16(29)7-3-6-15(28)30-11-12-8-9-13-4-1-2-5-14(13)10-12/h1-2,4-5,8-10H,3,6-7,11H2
InChIKey RXUPBGCPWSRBMO-UHFFFAOYSA-N
Mol Weight 438.35 g/mol
Molecular Formula C22H15F5O4
Exact Mass 438.08905 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 70oDpTXyfoL
Name Glutaric acid, naphth-2-ylmethyl pentafluorophenyl ester
Comments Computed using HOSE algorithm
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Exact Mass 438.089049774 u
Formula C22H15F5O4
InChI InChI=1S/C22H15F5O4/c23-17-18(24)20(26)22(21(27)19(17)25)31-16(29)7-3-6-15(28)30-11-12-8-9-13-4-1-2-5-14(13)10-12/h1-2,4-5,8-10H,3,6-7,11H2
InChIKey RXUPBGCPWSRBMO-UHFFFAOYSA-N
Molecular Weight 438.350 g/mol
SMILES C(CCC(OCC1=CC2=C(C=CC=C2)C=C1)=O)C(OC1=C(C(=C(C(=C1F)F)F)F)F)=O