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

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Glutaric acid, monoamide, N-(4-methylbenzyl)-, nonyl ester
SpectraBase Compound ID Cdper7ex3CM
InChI InChI=1S/C22H35NO3/c1-3-4-5-6-7-8-9-17-26-22(25)12-10-11-21(24)23-18-20-15-13-19(2)14-16-20/h13-16H,3-12,17-18H2,1-2H3,(H,23,24)
InChIKey RHPJOTWNZVTHHE-UHFFFAOYSA-N
Mol Weight 361.5 g/mol
Molecular Formula C22H35NO3
Exact Mass 361.261694 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CbKva2LvToX
Name Glutaric acid, monoamide, N-(4-methylbenzyl)-, nonyl ester
Comments Computed using HOSE algorithm
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Exact Mass 361.261693988 u
Formula C22H35NO3
InChI InChI=1S/C22H35NO3/c1-3-4-5-6-7-8-9-17-26-22(25)12-10-11-21(24)23-18-20-15-13-19(2)14-16-20/h13-16H,3-12,17-18H2,1-2H3,(H,23,24)
InChIKey RHPJOTWNZVTHHE-UHFFFAOYSA-N
Molecular Weight 361.526 g/mol
SMILES CCCCCCCCCOC(CCCC(NCC1=CC=C(C=C1)C)=O)=O