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L-Alanine, N-(p-toluoyl)-, undec-10-enyl ester

View entire compound with spectra: 1 NMR

L-Alanine, N-(p-toluoyl)-, undec-10-enyl ester
SpectraBase Compound ID Eg28FVqqAqK
InChI InChI=1S/C22H33NO3/c1-4-5-6-7-8-9-10-11-12-17-26-22(25)19(3)23-21(24)20-15-13-18(2)14-16-20/h4,13-16,19H,1,5-12,17H2,2-3H3,(H,23,24)
InChIKey VURZLAWEDGDBJF-UHFFFAOYSA-N
Mol Weight 359.5 g/mol
Molecular Formula C22H33NO3
Exact Mass 359.246044 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3jxHSYuutij
Name L-Alanine, N-(p-toluoyl)-, undec-10-enyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 359.246043924 u
Formula C22H33NO3
InChI InChI=1S/C22H33NO3/c1-4-5-6-7-8-9-10-11-12-17-26-22(25)19(3)23-21(24)20-15-13-18(2)14-16-20/h4,13-16,19H,1,5-12,17H2,2-3H3,(H,23,24)
InChIKey VURZLAWEDGDBJF-UHFFFAOYSA-N
Molecular Weight 359.510 g/mol
SMILES C1=CC(=CC=C1C(NC(C(OCCCCCCCCCC=C)=O)C)=O)C