SpectraBase Spectrum ID |
CL8RzQXGxto |
Name |
2H-Benz[E]-1,3-oxazine-4(3H)-one, 2-ethylidene-3-methyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
189.078978596 u |
Formula |
C11H11NO2 |
InChI |
InChI=1S/C11H11NO2/c1-3-10-12(2)11(13)8-6-4-5-7-9(8)14-10/h3-7H,1-2H3/b10-3- |
InChIKey |
YXIKGDJDSBAFRJ-KMKOMSMNSA-N |
Molecular Weight |
189.214 g/mol |
SMILES |
C1=CC2=C(C(N(\C(O2)=C\C)C)=O)C=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.945985 |