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.Gamma.-aminobutyric acid, N-isobutoxycarbonyl-, tetradecyl ester

View entire compound with spectra: 1 NMR

.Gamma.-aminobutyric acid, N-isobutoxycarbonyl-, tetradecyl ester
SpectraBase Compound ID CoLAZDuZ54f
InChI InChI=1S/C23H45NO4/c1-4-5-6-7-8-9-10-11-12-13-14-15-19-27-22(25)17-16-18-24-23(26)28-20-21(2)3/h21H,4-20H2,1-3H3,(H,24,26)
InChIKey ZFEUCJNQPMYNLE-UHFFFAOYSA-N
Mol Weight 399.6 g/mol
Molecular Formula C23H45NO4
Exact Mass 399.334859 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DCxzOWPXOfL
Name .Gamma.-aminobutyric acid, N-isobutoxycarbonyl-, tetradecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 399.334858929 u
Formula C23H45NO4
InChI InChI=1S/C23H45NO4/c1-4-5-6-7-8-9-10-11-12-13-14-15-19-27-22(25)17-16-18-24-23(26)28-20-21(2)3/h21H,4-20H2,1-3H3,(H,24,26)
InChIKey ZFEUCJNQPMYNLE-UHFFFAOYSA-N
Molecular Weight 399.616 g/mol
SMILES CC(COC(NCCCC(OCCCCCCCCCCCCCC)=O)=O)C