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L-Phenylalanine, N-propargyloxycarbonyl-, nonyl ester

View entire compound with spectra: 1 NMR

L-Phenylalanine, N-propargyloxycarbonyl-, nonyl ester
SpectraBase Compound ID IeD89D0KSoB
InChI InChI=1S/C22H31NO4/c1-3-5-6-7-8-9-13-17-26-21(24)20(23-22(25)27-16-4-2)18-19-14-11-10-12-15-19/h2,10-12,14-15,20H,3,5-9,13,16-18H2,1H3,(H,23,25)
InChIKey RLFAMLFMPIBWMM-UHFFFAOYSA-N
Mol Weight 373.49 g/mol
Molecular Formula C22H31NO4
Exact Mass 373.225308 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HjjhivZsSAd
Name L-Phenylalanine, N-propargyloxycarbonyl-, nonyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 373.225308478 u
Formula C22H31NO4
InChI InChI=1S/C22H31NO4/c1-3-5-6-7-8-9-13-17-26-21(24)20(23-22(25)27-16-4-2)18-19-14-11-10-12-15-19/h2,10-12,14-15,20H,3,5-9,13,16-18H2,1H3,(H,23,25)
InChIKey RLFAMLFMPIBWMM-UHFFFAOYSA-N
Molecular Weight 373.493 g/mol
SMILES C#CCOC(NC(C(OCCCCCCCCC)=O)CC1=CC=CC=C1)=O