SpectraBase Spectrum ID |
L0E1fRJA6Kd |
Name |
3-Methyl-5-[p-anisyl]-2H-1,3[3H]-oxazine-2,6-dione |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
233.068807834 u |
Formula |
C12H11NO4 |
InChI |
InChI=1S/C12H11NO4/c1-13-7-10(11(14)17-12(13)15)8-3-5-9(16-2)6-4-8/h3-7H,1-2H3 |
InChIKey |
VCIHNJYYNSEDHX-UHFFFAOYSA-N |
Molecular Weight |
233.223 g/mol |
SMILES |
C1=C(C(OC(N1C)=O)=O)C1=CC=C(C=C1)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.813129 |