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Terephthalic acid, monoamide, N-(2-fluorophenyl)-, hexyl ester

View entire compound with spectra: 1 NMR

Terephthalic acid, monoamide, N-(2-fluorophenyl)-, hexyl ester
SpectraBase Compound ID 1gr92VW5qZB
InChI InChI=1S/C20H22FNO3/c1-2-3-4-7-14-25-20(24)16-12-10-15(11-13-16)19(23)22-18-9-6-5-8-17(18)21/h5-6,8-13H,2-4,7,14H2,1H3,(H,22,23)
InChIKey ICVOXGZFTZZLQN-UHFFFAOYSA-N
Mol Weight 343.4 g/mol
Molecular Formula C20H22FNO3
Exact Mass 343.158372 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LuhIhbsJV6i
Name Terephthalic acid, monoamide, N-(2-fluorophenyl)-, hexyl ester
Comments Computed using HOSE algorithm
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Exact Mass 343.158371732 u
Formula C20H22FNO3
InChI InChI=1S/C20H22FNO3/c1-2-3-4-7-14-25-20(24)16-12-10-15(11-13-16)19(23)22-18-9-6-5-8-17(18)21/h5-6,8-13H,2-4,7,14H2,1H3,(H,22,23)
InChIKey ICVOXGZFTZZLQN-UHFFFAOYSA-N
Molecular Weight 343.398 g/mol
SMILES C(COC(=O)C1=CC=C(C=C1)C(=O)NC1=CC=CC=C1F)CCCC