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L-Leucine, N-methyl-N-(2-(benzyloxy)ethoxycarbonyl)-, dodecyl ester

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L-Leucine, N-methyl-N-(2-(benzyloxy)ethoxycarbonyl)-, dodecyl ester
SpectraBase Compound ID B3kA28W8Jlx
InChI InChI=1S/C29H49NO5/c1-5-6-7-8-9-10-11-12-13-17-20-34-28(31)27(23-25(2)3)30(4)29(32)35-22-21-33-24-26-18-15-14-16-19-26/h14-16,18-19,25,27H,5-13,17,20-24H2,1-4H3/t27-/m0/s1
InChIKey LPWSGAITAZLTGG-MHZLTWQESA-N
Mol Weight 491.7 g/mol
Molecular Formula C29H49NO5
Exact Mass 491.361074 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EG7fSgSpzqA
Name L-Leucine, N-methyl-N-(2-(benzyloxy)ethoxycarbonyl)-, dodecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 491.361073677 u
Formula C29H49NO5
InChI InChI=1S/C29H49NO5/c1-5-6-7-8-9-10-11-12-13-17-20-34-28(31)27(23-25(2)3)30(4)29(32)35-22-21-33-24-26-18-15-14-16-19-26/h14-16,18-19,25,27H,5-13,17,20-24H2,1-4H3/t27-/m0/s1
InChIKey LPWSGAITAZLTGG-MHZLTWQESA-N
Molecular Weight 491.713 g/mol
SMILES C(C)(C)C[C@@](C(OCCCCCCCCCCCC)=O)(N(C)C(=O)OCCOCC1=CC=CC=C1)[H]