SpectraBase Spectrum ID |
6Vl22o4JCza |
Name |
2H-1,3,4-Oxadiazin-2-one, 3,6-dihydro-5,6-dimethyl-6-phenyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
204.089877632 u |
Formula |
C11H12N2O2 |
InChI |
InChI=1S/C11H12N2O2/c1-8-11(2,15-10(14)13-12-8)9-6-4-3-5-7-9/h3-7H,1-2H3,(H,13,14) |
InChIKey |
CWZAHGNWKZHUDH-UHFFFAOYSA-N |
Molecular Weight |
204.229 g/mol |
SMILES |
C1(OC(=O)NN=C1C)(C=1C=CC=CC1)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.801358 |