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Glutaric acid, 2-fluorophenyl 4-chloro-2-methoxyphenyl ester
SpectraBase Compound ID 5da6m3tPNdL
InChI InChI=1S/C18H16ClFO5/c1-23-16-11-12(19)9-10-15(16)25-18(22)8-4-7-17(21)24-14-6-3-2-5-13(14)20/h2-3,5-6,9-11H,4,7-8H2,1H3
InChIKey LDZMTXLYDDPVJY-UHFFFAOYSA-N
Mol Weight 366.77 g/mol
Molecular Formula C18H16ClFO5
Exact Mass 366.067029 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L3z6RO6ClJP
Name Glutaric acid, 2-fluorophenyl 4-chloro-2-methoxyphenyl ester
Comments Computed using HOSE algorithm
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Exact Mass 366.067029473 u
Formula C18H16ClFO5
InChI InChI=1S/C18H16ClFO5/c1-23-16-11-12(19)9-10-15(16)25-18(22)8-4-7-17(21)24-14-6-3-2-5-13(14)20/h2-3,5-6,9-11H,4,7-8H2,1H3
InChIKey LDZMTXLYDDPVJY-UHFFFAOYSA-N
Molecular Weight 366.772 g/mol
SMILES C(CCC(OC1=CC=CC=C1F)=O)C(OC1=CC=C(C=C1OC)Cl)=O