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Isophthalic acid, monoamide, N-(2-fluorophenyl)-, nonyl ester

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Isophthalic acid, monoamide, N-(2-fluorophenyl)-, nonyl ester
SpectraBase Compound ID 9Tu7Y9fr158
InChI InChI=1S/C23H28FNO3/c1-2-3-4-5-6-7-10-16-28-23(27)19-13-11-12-18(17-19)22(26)25-21-15-9-8-14-20(21)24/h8-9,11-15,17H,2-7,10,16H2,1H3,(H,25,26)
InChIKey ULTQPKRGBQCOTM-UHFFFAOYSA-N
Mol Weight 385.48 g/mol
Molecular Formula C23H28FNO3
Exact Mass 385.205322 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Fo2fzDRH3aY
Name Isophthalic acid, monoamide, N-(2-fluorophenyl)-, nonyl ester
Comments Computed using HOSE algorithm
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Exact Mass 385.205321926 u
Formula C23H28FNO3
InChI InChI=1S/C23H28FNO3/c1-2-3-4-5-6-7-10-16-28-23(27)19-13-11-12-18(17-19)22(26)25-21-15-9-8-14-20(21)24/h8-9,11-15,17H,2-7,10,16H2,1H3,(H,25,26)
InChIKey ULTQPKRGBQCOTM-UHFFFAOYSA-N
Molecular Weight 385.479 g/mol
SMILES C1=CC(=C(C=C1)NC(C1=CC(=CC=C1)C(OCCCCCCCCC)=O)=O)F