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

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Glutaric acid, monoamide, N-(1-phenylethyl)-, octyl ester
SpectraBase Compound ID 3L1Qk8nkau9
InChI InChI=1S/C21H33NO3/c1-3-4-5-6-7-11-17-25-21(24)16-12-15-20(23)22-18(2)19-13-9-8-10-14-19/h8-10,13-14,18H,3-7,11-12,15-17H2,1-2H3,(H,22,23)
InChIKey HAGOBEVORYDVOS-UHFFFAOYSA-N
Mol Weight 347.5 g/mol
Molecular Formula C21H33NO3
Exact Mass 347.246044 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F7DVaTGeflI
Name Glutaric acid, monoamide, N-(1-phenylethyl)-, octyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 347.246043924 u
Formula C21H33NO3
InChI InChI=1S/C21H33NO3/c1-3-4-5-6-7-11-17-25-21(24)16-12-15-20(23)22-18(2)19-13-9-8-10-14-19/h8-10,13-14,18H,3-7,11-12,15-17H2,1-2H3,(H,22,23)
InChIKey HAGOBEVORYDVOS-UHFFFAOYSA-N
Molecular Weight 347.499 g/mol
SMILES CC(NC(CCCC(OCCCCCCCC)=O)=O)C1=CC=CC=C1