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Glutaric acid, monoamide, N-(5-chloro-2-methoxyphenyl)-, nonyl ester
SpectraBase Compound ID BlzL7foKKuL
InChI InChI=1S/C21H32ClNO4/c1-3-4-5-6-7-8-9-15-27-21(25)12-10-11-20(24)23-18-16-17(22)13-14-19(18)26-2/h13-14,16H,3-12,15H2,1-2H3,(H,23,24)
InChIKey IHKKLQJXTJDSLF-UHFFFAOYSA-N
Mol Weight 397.9 g/mol
Molecular Formula C21H32ClNO4
Exact Mass 397.201986 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FY8z3CaxQ4c
Name Glutaric acid, monoamide, N-(5-chloro-2-methoxyphenyl)-, nonyl ester
Comments Computed using HOSE algorithm
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Exact Mass 397.201986210 u
Formula C21H32ClNO4
InChI InChI=1S/C21H32ClNO4/c1-3-4-5-6-7-8-9-15-27-21(25)12-10-11-20(24)23-18-16-17(22)13-14-19(18)26-2/h13-14,16H,3-12,15H2,1-2H3,(H,23,24)
InChIKey IHKKLQJXTJDSLF-UHFFFAOYSA-N
Molecular Weight 397.943 g/mol
SMILES CCCCCCCCCOC(CCCC(NC1=CC(=CC=C1OC)Cl)=O)=O