SpectraBase Spectrum ID |
5lu69FlWRzl |
Name |
Benzyl (S)-(-)-4-oxo-2-azetidinecarboxylate |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
205.073893215 u |
Formula |
C11H11NO3 |
InChI |
InChI=1S/C11H11NO3/c13-10-6-9(12-10)11(14)15-7-8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,12,13)/t9-/m0/s1 |
InChIKey |
WGLLBHSIXLWVFU-VIFPVBQESA-N |
Molecular Weight |
205.213 g/mol |
SMILES |
C1(N[C@@](C1)(C(OCC1=CC=CC=C1)=O)[H])=O |
Spectrum/Structure Validation Score (Raman) |
0.984317 |