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1-Aminocyclopentanecarboxylic acid, N-propyloxycarbonyl-, heptadecyl ester

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

1-Aminocyclopentanecarboxylic acid, N-propyloxycarbonyl-, heptadecyl ester
SpectraBase Compound ID Gf5HiQlwJIG
InChI InChI=1S/C27H51NO4/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-20-24-31-25(29)27(21-18-19-22-27)28-26(30)32-23-4-2/h3-24H2,1-2H3,(H,28,30)
InChIKey MECLFZGAGFIUDA-UHFFFAOYSA-N
Mol Weight 453.7 g/mol
Molecular Formula C27H51NO4
Exact Mass 453.381809 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Lhv4NVUMcGH
Name 1-Aminocyclopentanecarboxylic acid, N-propyloxycarbonyl-, heptadecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 453.381809122 u
Formula C27H51NO4
InChI InChI=1S/C27H51NO4/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-20-24-31-25(29)27(21-18-19-22-27)28-26(30)32-23-4-2/h3-24H2,1-2H3,(H,28,30)
InChIKey MECLFZGAGFIUDA-UHFFFAOYSA-N
Molecular Weight 453.708 g/mol
SMILES CCCOC(NC1(C(OCCCCCCCCCCCCCCCCC)=O)CCCC1)=O