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L-Leucine, N-isobutoxycarbonyl-N-methyl-, octadecyl ester
SpectraBase Compound ID BATa8Vhybw5
InChI InChI=1S/C30H59NO4/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-34-29(32)28(24-26(2)3)31(6)30(33)35-25-27(4)5/h26-28H,7-25H2,1-6H3
InChIKey AYKJWKHVOIPLMQ-UHFFFAOYSA-N
Mol Weight 497.8 g/mol
Molecular Formula C30H59NO4
Exact Mass 497.444409 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1xKvH4U7moy
Name L-Leucine, N-isobutoxycarbonyl-N-methyl-, octadecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 497.444409380 u
Formula C30H59NO4
InChI InChI=1S/C30H59NO4/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-34-29(32)28(24-26(2)3)31(6)30(33)35-25-27(4)5/h26-28H,7-25H2,1-6H3
InChIKey AYKJWKHVOIPLMQ-UHFFFAOYSA-N
Molecular Weight 497.805 g/mol
SMILES CC(C)COC(N(C(C(OCCCCCCCCCCCCCCCCCC)=O)CC(C)C)C)=O