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Phenylalanine, dl, .alpha.-methyl-N-(N-pentyl)-, N-pentyl ester

View entire compound with spectra: 1 NMR

Phenylalanine, dl, .alpha.-methyl-N-(N-pentyl)-, N-pentyl ester
SpectraBase Compound ID 90OGJczImDC
InChI InChI=1S/C20H33NO2/c1-4-6-11-15-21-20(3,17-18-13-9-8-10-14-18)19(22)23-16-12-7-5-2/h8-10,13-14,21H,4-7,11-12,15-17H2,1-3H3
InChIKey UAYVJGNZHXEDQL-UHFFFAOYSA-N
Mol Weight 319.5 g/mol
Molecular Formula C20H33NO2
Exact Mass 319.251129 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5C9dP8adGEO
Name Phenylalanine, dl, .alpha.-methyl-N-(N-pentyl)-, N-pentyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 319.251129305 u
Formula C20H33NO2
InChI InChI=1S/C20H33NO2/c1-4-6-11-15-21-20(3,17-18-13-9-8-10-14-18)19(22)23-16-12-7-5-2/h8-10,13-14,21H,4-7,11-12,15-17H2,1-3H3
InChIKey UAYVJGNZHXEDQL-UHFFFAOYSA-N
Molecular Weight 319.489 g/mol
SMILES C1(=CC=CC=C1)CC(C)(NCCCCC)C(=O)OCCCCC