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L-Alanine, N-benzyloxycarbonyl-, tetradecyl ester

View entire compound with spectra: 1 NMR

L-Alanine, N-benzyloxycarbonyl-, tetradecyl ester
SpectraBase Compound ID EhuqbYijpvi
InChI InChI=1S/C25H41NO4/c1-3-4-5-6-7-8-9-10-11-12-13-17-20-29-24(27)22(2)26-25(28)30-21-23-18-15-14-16-19-23/h14-16,18-19,22H,3-13,17,20-21H2,1-2H3,(H,26,28)/t22-/m0/s1
InChIKey LNNDLJRLBXYDNV-QFIPXVFZSA-N
Mol Weight 419.6 g/mol
Molecular Formula C25H41NO4
Exact Mass 419.303559 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DzU5SqhdAPT
Name L-Alanine, N-benzyloxycarbonyl-, tetradecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 419.303558800 u
Formula C25H41NO4
InChI InChI=1S/C25H41NO4/c1-3-4-5-6-7-8-9-10-11-12-13-17-20-29-24(27)22(2)26-25(28)30-21-23-18-15-14-16-19-23/h14-16,18-19,22H,3-13,17,20-21H2,1-2H3,(H,26,28)/t22-/m0/s1
InChIKey LNNDLJRLBXYDNV-QFIPXVFZSA-N
Molecular Weight 419.606 g/mol
SMILES C([C@@](NC(OCC1=CC=CC=C1)=O)(C)[H])(OCCCCCCCCCCCCCC)=O