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L-Methionine, N-ethoxycarbonyl-, hexadecyl ester

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L-Methionine, N-ethoxycarbonyl-, hexadecyl ester
SpectraBase Compound ID 3GjudzYjcHK
InChI InChI=1S/C24H47NO4S/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-20-29-23(26)22(19-21-30-3)25-24(27)28-5-2/h22H,4-21H2,1-3H3,(H,25,27)
InChIKey AADIIHPLMPZWIF-UHFFFAOYSA-N
Mol Weight 445.7 g/mol
Molecular Formula C24H47NO4S
Exact Mass 445.32258 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID I3nUtxLBAg9
Name L-Methionine, N-ethoxycarbonyl-, hexadecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 445.322580167 u
Formula C24H47NO4S
InChI InChI=1S/C24H47NO4S/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-20-29-23(26)22(19-21-30-3)25-24(27)28-5-2/h22H,4-21H2,1-3H3,(H,25,27)
InChIKey AADIIHPLMPZWIF-UHFFFAOYSA-N
Molecular Weight 445.703 g/mol
SMILES CCOC(NC(C(OCCCCCCCCCCCCCCCC)=O)CCSC)=O