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Glutaric acid, monoamide, N-(4-methylbenzyl)-, heptyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, monoamide, N-(4-methylbenzyl)-, heptyl ester
SpectraBase Compound ID 4PU47UYGFdW
InChI InChI=1S/C20H31NO3/c1-3-4-5-6-7-15-24-20(23)10-8-9-19(22)21-16-18-13-11-17(2)12-14-18/h11-14H,3-10,15-16H2,1-2H3,(H,21,22)
InChIKey PUWCBVFGSFHTPO-UHFFFAOYSA-N
Mol Weight 333.47 g/mol
Molecular Formula C20H31NO3
Exact Mass 333.230394 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1CQ7ZV7tw5m
Name Glutaric acid, monoamide, N-(4-methylbenzyl)-, heptyl ester
Comments Computed using HOSE algorithm
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Exact Mass 333.230393859 u
Formula C20H31NO3
InChI InChI=1S/C20H31NO3/c1-3-4-5-6-7-15-24-20(23)10-8-9-19(22)21-16-18-13-11-17(2)12-14-18/h11-14H,3-10,15-16H2,1-2H3,(H,21,22)
InChIKey PUWCBVFGSFHTPO-UHFFFAOYSA-N
Molecular Weight 333.472 g/mol
SMILES CCCCCCCOC(CCCC(NCC1=CC=C(C=C1)C)=O)=O