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L-Phenylalanine, N-ethoxycarbonyl-, dodecyl ester

View entire compound with spectra: 1 NMR

L-Phenylalanine, N-ethoxycarbonyl-, dodecyl ester
SpectraBase Compound ID 8ANJHoNjzsH
InChI InChI=1S/C24H39NO4/c1-3-5-6-7-8-9-10-11-12-16-19-29-23(26)22(25-24(27)28-4-2)20-21-17-14-13-15-18-21/h13-15,17-18,22H,3-12,16,19-20H2,1-2H3,(H,25,27)
InChIKey LVBXTBKKEQOHMY-UHFFFAOYSA-N
Mol Weight 405.6 g/mol
Molecular Formula C24H39NO4
Exact Mass 405.287909 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Af7ohUAd4dO
Name L-Phenylalanine, N-ethoxycarbonyl-, dodecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 405.287908736 u
Formula C24H39NO4
InChI InChI=1S/C24H39NO4/c1-3-5-6-7-8-9-10-11-12-16-19-29-23(26)22(25-24(27)28-4-2)20-21-17-14-13-15-18-21/h13-15,17-18,22H,3-12,16,19-20H2,1-2H3,(H,25,27)
InChIKey LVBXTBKKEQOHMY-UHFFFAOYSA-N
Molecular Weight 405.579 g/mol
SMILES CCOC(NC(C(OCCCCCCCCCCCC)=O)CC1=CC=CC=C1)=O