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L-Phenylalanine, N-allyloxycarbonyl-, hexyl ester
SpectraBase Compound ID 8RDlhn9Mvwq
InChI InChI=1S/C19H27NO4/c1-3-5-6-10-14-23-18(21)17(20-19(22)24-13-4-2)15-16-11-8-7-9-12-16/h4,7-9,11-12,17H,2-3,5-6,10,13-15H2,1H3,(H,20,22)
InChIKey RXOSROAPAVYSNM-UHFFFAOYSA-N
Mol Weight 333.43 g/mol
Molecular Formula C19H27NO4
Exact Mass 333.194008 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8PyvPaZ6uR5
Name L-Phenylalanine, N-allyloxycarbonyl-, hexyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 333.194008349 u
Formula C19H27NO4
InChI InChI=1S/C19H27NO4/c1-3-5-6-10-14-23-18(21)17(20-19(22)24-13-4-2)15-16-11-8-7-9-12-16/h4,7-9,11-12,17H,2-3,5-6,10,13-15H2,1H3,(H,20,22)
InChIKey RXOSROAPAVYSNM-UHFFFAOYSA-N
Molecular Weight 333.428 g/mol
SMILES C=CCOC(NC(C(OCCCCCC)=O)CC1=CC=CC=C1)=O