| SpectraBase Spectrum ID |
8dCtWp9FSQz |
| Name |
Phenylalanine, 4-acetylamino-N-T-butoxycarbonyl-, T-butyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
378.215472069 u |
| Formula |
C20H30N2O5 |
| InChI |
InChI=1S/C20H30N2O5/c1-13(23)21-15-10-8-14(9-11-15)12-16(17(24)26-19(2,3)4)22-18(25)27-20(5,6)7/h8-11,16H,12H2,1-7H3,(H,21,23)(H,22,25) |
| InChIKey |
SXRFGJLXJMAACC-UHFFFAOYSA-N |
| Molecular Weight |
378.469 g/mol |
| SMILES |
C1=CC(=CC=C1NC(C)=O)CC(C(OC(C)(C)C)=O)NC(OC(C)(C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.854258 |
