For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

Tert-leucine, N-isobutoxycarbonyl-, heptadecyl ester

View entire compound with spectra: 1 NMR, and 1 FTIR

Tert-leucine, N-isobutoxycarbonyl-, heptadecyl ester
SpectraBase Compound ID DQ4piWrEG5v
InChI InChI=1S/C28H55NO4/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-32-26(30)25(28(4,5)6)29-27(31)33-23-24(2)3/h24-25H,7-23H2,1-6H3,(H,29,31)
InChIKey COKYQPINACOEGE-UHFFFAOYSA-N
Mol Weight 469.8 g/mol
Molecular Formula C28H55NO4
Exact Mass 469.413109 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

Subscribe to view the full spectrum.

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID Eutwx3FaC0j
Name Tert-leucine, N-isobutoxycarbonyl-, heptadecyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 469.413109251 u
Formula C28H55NO4
InChI InChI=1S/C28H55NO4/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-32-26(30)25(28(4,5)6)29-27(31)33-23-24(2)3/h24-25H,7-23H2,1-6H3,(H,29,31)
InChIKey COKYQPINACOEGE-UHFFFAOYSA-N
Molecular Weight 469.751 g/mol
SMILES CCCCCCCCCCCCCCCCCOC(C(NC(OCC(C)C)=O)C(C)(C)C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.843689