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Glutaric acid, naphth-2-ylmethyl 3-fluorophenyl ester
SpectraBase Compound ID IAdKGdSRA9d
InChI InChI=1S/C22H19FO4/c23-19-7-3-8-20(14-19)27-22(25)10-4-9-21(24)26-15-16-11-12-17-5-1-2-6-18(17)13-16/h1-3,5-8,11-14H,4,9-10,15H2
InChIKey LYXSNYGHZGLCPB-UHFFFAOYSA-N
Mol Weight 366.39 g/mol
Molecular Formula C22H19FO4
Exact Mass 366.126737 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FYAbSBLVzLo
Name Glutaric acid, naphth-2-ylmethyl 3-fluorophenyl ester
Comments Computed using HOSE algorithm
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Exact Mass 366.126737251 u
Formula C22H19FO4
InChI InChI=1S/C22H19FO4/c23-19-7-3-8-20(14-19)27-22(25)10-4-9-21(24)26-15-16-11-12-17-5-1-2-6-18(17)13-16/h1-3,5-8,11-14H,4,9-10,15H2
InChIKey LYXSNYGHZGLCPB-UHFFFAOYSA-N
Molecular Weight 366.388 g/mol
SMILES C(CCC(OCC1=CC2=C(C=CC=C2)C=C1)=O)C(OC1=CC=CC(=C1)F)=O