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Glutaric acid, monoamide, N-(1-phenylethyl)-, nonyl ester

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Glutaric acid, monoamide, N-(1-phenylethyl)-, nonyl ester
SpectraBase Compound ID E64yCwQjdhs
InChI InChI=1S/C22H35NO3/c1-3-4-5-6-7-8-12-18-26-22(25)17-13-16-21(24)23-19(2)20-14-10-9-11-15-20/h9-11,14-15,19H,3-8,12-13,16-18H2,1-2H3,(H,23,24)
InChIKey HXUXNYLEBGKTGS-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 At1OtOa86As
Name Glutaric acid, monoamide, N-(1-phenylethyl)-, nonyl ester
Comments Computed using HOSE algorithm
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Exact Mass 361.261693988 u
Formula C22H35NO3
InChI InChI=1S/C22H35NO3/c1-3-4-5-6-7-8-12-18-26-22(25)17-13-16-21(24)23-19(2)20-14-10-9-11-15-20/h9-11,14-15,19H,3-8,12-13,16-18H2,1-2H3,(H,23,24)
InChIKey HXUXNYLEBGKTGS-UHFFFAOYSA-N
Molecular Weight 361.526 g/mol
SMILES CC(NC(CCCC(OCCCCCCCCC)=O)=O)C1=CC=CC=C1