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Carbonic acid, monoamide, N-propyl-N-hexadecyl-, benzyl ester

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Carbonic acid, monoamide, N-propyl-N-hexadecyl-, benzyl ester
SpectraBase Compound ID 1tT1MXzirtr
InChI InChI=1S/C27H47NO2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-20-24-28(23-4-2)27(29)30-25-26-21-18-17-19-22-26/h17-19,21-22H,3-16,20,23-25H2,1-2H3
InChIKey OBNLZIURDZOSMS-UHFFFAOYSA-N
Mol Weight 417.7 g/mol
Molecular Formula C27H47NO2
Exact Mass 417.36068 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FtV6mWGqZwq
Name Carbonic acid, monoamide, N-propyl-N-hexadecyl-, benzyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 417.360679755 u
Formula C27H47NO2
InChI InChI=1S/C27H47NO2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-20-24-28(23-4-2)27(29)30-25-26-21-18-17-19-22-26/h17-19,21-22H,3-16,20,23-25H2,1-2H3
InChIKey OBNLZIURDZOSMS-UHFFFAOYSA-N
Molecular Weight 417.678 g/mol
SMILES C(N(CCC)CCCCCCCCCCCCCCCC)(=O)OCC=1C=CC=CC1