| SpectraBase Spectrum ID |
Ai8V7xY3gEG |
| Name |
(2S)-2-(Benzyloxycarbonylamino)-4-phenyl-butyric acid methyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
327.147058156 u |
| Formula |
C19H21NO4 |
| InChI |
InChI=1S/C19H21NO4/c1-23-18(21)17(13-12-15-8-4-2-5-9-15)20-19(22)24-14-16-10-6-3-7-11-16/h2-11,17H,12-14H2,1H3,(H,20,22)/t17-/m0/s1 |
| InChIKey |
SCBBQEIEMVKRNX-KRWDZBQOSA-N |
| Molecular Weight |
327.380 g/mol |
| SMILES |
C(N[C@](C(=O)OC)(CCC1=CC=CC=C1)[H])(=O)OCC=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.906684 |
