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

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Glutaric acid, monoamide, N-(1-phenylethyl)-, octadecyl ester
SpectraBase Compound ID 49AyOU2AgQa
InChI InChI=1S/C31H53NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-27-35-31(34)26-22-25-30(33)32-28(2)29-23-19-18-20-24-29/h18-20,23-24,28H,3-17,21-22,25-27H2,1-2H3,(H,32,33)
InChIKey ZWYPOKINJVMGFW-UHFFFAOYSA-N
Mol Weight 487.8 g/mol
Molecular Formula C31H53NO3
Exact Mass 487.402545 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1iakdpobTPj
Name Glutaric acid, monoamide, N-(1-phenylethyl)-, octadecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 487.402544568 u
Formula C31H53NO3
InChI InChI=1S/C31H53NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-27-35-31(34)26-22-25-30(33)32-28(2)29-23-19-18-20-24-29/h18-20,23-24,28H,3-17,21-22,25-27H2,1-2H3,(H,32,33)
InChIKey ZWYPOKINJVMGFW-UHFFFAOYSA-N
Molecular Weight 487.769 g/mol
SMILES CC(NC(CCCC(OCCCCCCCCCCCCCCCCCC)=O)=O)C1=CC=CC=C1