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Oxalic acid, monoamide, N-(2-fluorophenyl)-, heptyl ester
SpectraBase Compound ID KNGbrbGi9I3
InChI InChI=1S/C15H20FNO3/c1-2-3-4-5-8-11-20-15(19)14(18)17-13-10-7-6-9-12(13)16/h6-7,9-10H,2-5,8,11H2,1H3,(H,17,18)
InChIKey FILRHIKBLNPWPR-UHFFFAOYSA-N
Mol Weight 281.33 g/mol
Molecular Formula C15H20FNO3
Exact Mass 281.142722 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BzeIyamg82e
Name Oxalic acid, monoamide, N-(2-fluorophenyl)-, heptyl ester
Comments Computed using HOSE algorithm
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Exact Mass 281.142721668 u
Formula C15H20FNO3
InChI InChI=1S/C15H20FNO3/c1-2-3-4-5-8-11-20-15(19)14(18)17-13-10-7-6-9-12(13)16/h6-7,9-10H,2-5,8,11H2,1H3,(H,17,18)
InChIKey FILRHIKBLNPWPR-UHFFFAOYSA-N
Molecular Weight 281.327 g/mol
SMILES C(C(=O)NC1=C(C=CC=C1)F)(OCCCCCCC)=O