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L-Phenylalanine, N-butoxycarbonyl-, dodecyl ester

View entire compound with spectra: 1 NMR

L-Phenylalanine, N-butoxycarbonyl-, dodecyl ester
SpectraBase Compound ID 5wXiVnaekog
InChI InChI=1S/C26H43NO4/c1-3-5-7-8-9-10-11-12-13-17-21-30-25(28)24(22-23-18-15-14-16-19-23)27-26(29)31-20-6-4-2/h14-16,18-19,24H,3-13,17,20-22H2,1-2H3,(H,27,29)
InChIKey XOGQTGFZCDMDAN-UHFFFAOYSA-N
Mol Weight 433.6 g/mol
Molecular Formula C26H43NO4
Exact Mass 433.319209 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2zAm6v2SXFW
Name L-Phenylalanine, N-butoxycarbonyl-, dodecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 433.319208865 u
Formula C26H43NO4
InChI InChI=1S/C26H43NO4/c1-3-5-7-8-9-10-11-12-13-17-21-30-25(28)24(22-23-18-15-14-16-19-23)27-26(29)31-20-6-4-2/h14-16,18-19,24H,3-13,17,20-22H2,1-2H3,(H,27,29)
InChIKey XOGQTGFZCDMDAN-UHFFFAOYSA-N
Molecular Weight 433.633 g/mol
SMILES CCCCOC(NC(C(OCCCCCCCCCCCC)=O)CC1=CC=CC=C1)=O