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Carbonic acid, monoamide, N-benzyl-N-tetradecyl-, hexyl ester

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Carbonic acid, monoamide, N-benzyl-N-tetradecyl-, hexyl ester
SpectraBase Compound ID 8TFjiZpK5Ue
InChI InChI=1S/C28H49NO2/c1-3-5-7-9-10-11-12-13-14-15-16-20-24-29(26-27-22-18-17-19-23-27)28(30)31-25-21-8-6-4-2/h17-19,22-23H,3-16,20-21,24-26H2,1-2H3
InChIKey PULIILYJNKXUMQ-UHFFFAOYSA-N
Mol Weight 431.7 g/mol
Molecular Formula C28H49NO2
Exact Mass 431.37633 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JkKAQDlrV3V
Name Carbonic acid, monoamide, N-benzyl-N-tetradecyl-, hexyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 431.376329820 u
Formula C28H49NO2
InChI InChI=1S/C28H49NO2/c1-3-5-7-9-10-11-12-13-14-15-16-20-24-29(26-27-22-18-17-19-23-27)28(30)31-25-21-8-6-4-2/h17-19,22-23H,3-16,20-21,24-26H2,1-2H3
InChIKey PULIILYJNKXUMQ-UHFFFAOYSA-N
Molecular Weight 431.705 g/mol
SMILES CCCCCCOC(=O)N(CCCCCCCCCCCCCC)CC1=CC=CC=C1