| SpectraBase Spectrum ID |
Hl2DXchKBfV |
| Name |
L-Phenylalanine, N-allyloxycarbonyl-, butyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
305.162708221 u |
| Formula |
C17H23NO4 |
| InChI |
InChI=1S/C17H23NO4/c1-3-5-12-21-16(19)15(18-17(20)22-11-4-2)13-14-9-7-6-8-10-14/h4,6-10,15H,2-3,5,11-13H2,1H3,(H,18,20) |
| InChIKey |
VMZRKVNSKXQLAS-UHFFFAOYSA-N |
| SMILES |
C=CCOC(NC(C(OCCCC)=O)CC1=CC=CC=C1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.947025 |
