| SpectraBase Spectrum ID |
J80cqnJVdkt |
| Name |
Erythro/threo-2-phenyl-1-[4-(phenylcarbomoyl)phenyl]ethane-1,2-diol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
333.136493473 u |
| Formula |
C21H19NO3 |
| InChI |
InChI=1S/C21H19NO3/c23-19(15-7-3-1-4-8-15)20(24)16-11-13-17(14-12-16)21(25)22-18-9-5-2-6-10-18/h1-14,19-20,23-24H,(H,22,25) |
| InChIKey |
ZEKMFZDFYIPPMJ-UHFFFAOYSA-N |
| Molecular Weight |
333.387 g/mol |
| SMILES |
C(NC1=CC=CC=C1)(C=1C=CC(C(C(C=2C=CC=CC2)O)O)=CC1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.951045 |
![Erythro/threo-2-phenyl-1-[4-(phenylcarbomoyl)phenyl]ethane-1,2-diol](/api/spectrum/J80cqnJVdkt/structure.png?h=300&w=458 "Erythro/threo-2-phenyl-1-[4-(phenylcarbomoyl)phenyl]ethane-1,2-diol")
