| SpectraBase Spectrum ID |
5U0qL6FsczO |
| Name |
3-(p-Aminophenyl)-3-ethyl-2-azetidinone, hydrochloride |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
226.087290810 u |
| Formula |
C11H15ClN2O |
| InChI |
InChI=1S/C11H14N2O.ClH/c1-2-11(7-13-10(11)14)8-3-5-9(12)6-4-8;/h3-6H,2,7,12H2,1H3,(H,13,14);1H |
| InChIKey |
UUAGSASYNUXPBX-UHFFFAOYSA-N |
| Molecular Weight |
226.707 g/mol |
| SMILES |
Cl.NC1=CC=C(C2(C(NC2)=O)CC)C=C1 |
| Spectrum/Structure Validation Score (Raman) |
0.789951 |
