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L-Phenylalanine, N-isobutoxycarbonyl-, nonyl ester

View entire compound with spectra: 1 NMR

L-Phenylalanine, N-isobutoxycarbonyl-, nonyl ester
SpectraBase Compound ID JZ8frcQ8qvD
InChI InChI=1S/C23H37NO4/c1-4-5-6-7-8-9-13-16-27-22(25)21(17-20-14-11-10-12-15-20)24-23(26)28-18-19(2)3/h10-12,14-15,19,21H,4-9,13,16-18H2,1-3H3,(H,24,26)
InChIKey SDNATUAPFNNJLK-UHFFFAOYSA-N
Mol Weight 391.6 g/mol
Molecular Formula C23H37NO4
Exact Mass 391.272259 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2cBWT4bKc90
Name L-Phenylalanine, N-isobutoxycarbonyl-, nonyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 391.272258671 u
Formula C23H37NO4
InChI InChI=1S/C23H37NO4/c1-4-5-6-7-8-9-13-16-27-22(25)21(17-20-14-11-10-12-15-20)24-23(26)28-18-19(2)3/h10-12,14-15,19,21H,4-9,13,16-18H2,1-3H3,(H,24,26)
InChIKey SDNATUAPFNNJLK-UHFFFAOYSA-N
Molecular Weight 391.552 g/mol
SMILES CC(C)COC(NC(C(OCCCCCCCCC)=O)CC1=CC=CC=C1)=O