| SpectraBase Spectrum ID |
CYH3CSJYPJj |
| Name |
6-oxo-5-Phenyl-1,3,4-oxadiazin-2-carboxylic-acid-methylester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
232.048406742 u |
| Formula |
C11H8N2O4 |
| InChI |
InChI=1S/C11H8N2O4/c1-16-11(15)9-13-12-8(10(14)17-9)7-5-3-2-4-6-7/h2-6H,1H3 |
| InChIKey |
DFABJSQTNOODIO-UHFFFAOYSA-N |
| Molecular Weight |
232.195 g/mol |
| SMILES |
C1(=NN=C(C(O1)=O)C1=CC=CC=C1)C(=O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.953884 |
