| SpectraBase Spectrum ID |
9sqctTTtPUI |
| Name |
1,4-Diphenyl-3-chloro-3-(tert-butoxycarbonyl)-azetidin-2-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
357.113171205 u |
| Formula |
C20H20ClNO3 |
| InChI |
InChI=1S/C20H20ClNO3/c1-19(2,3)25-18(24)20(21)16(14-10-6-4-7-11-14)22(17(20)23)15-12-8-5-9-13-15/h4-13,16H,1-3H3 |
| InChIKey |
HUDLWMAPXSGMQT-UHFFFAOYSA-N |
| Molecular Weight |
357.837 g/mol |
| SMILES |
C1(N(C(C1(C(OC(C)(C)C)=O)Cl)=O)C1=CC=CC=C1)C1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.863105 |
