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L-Phenylalanine, N-propargyloxycarbonyl-, decyl ester

View entire compound with spectra: 1 NMR

L-Phenylalanine, N-propargyloxycarbonyl-, decyl ester
SpectraBase Compound ID DsMN1J3eW83
InChI InChI=1S/C23H33NO4/c1-3-5-6-7-8-9-10-14-18-27-22(25)21(24-23(26)28-17-4-2)19-20-15-12-11-13-16-20/h2,11-13,15-16,21H,3,5-10,14,17-19H2,1H3,(H,24,26)
InChIKey NJCKLSUMZNFBQY-UHFFFAOYSA-N
Mol Weight 387.5 g/mol
Molecular Formula C23H33NO4
Exact Mass 387.240959 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BYxVUxcDPj1
Name L-Phenylalanine, N-propargyloxycarbonyl-, decyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 387.240958543 u
Formula C23H33NO4
InChI InChI=1S/C23H33NO4/c1-3-5-6-7-8-9-10-14-18-27-22(25)21(24-23(26)28-17-4-2)19-20-15-12-11-13-16-20/h2,11-13,15-16,21H,3,5-10,14,17-19H2,1H3,(H,24,26)
InChIKey NJCKLSUMZNFBQY-UHFFFAOYSA-N
Molecular Weight 387.520 g/mol
SMILES C#CCOC(NC(C(OCCCCCCCCCC)=O)CC1=CC=CC=C1)=O