SpectraBase Spectrum ID |
E4XerTHFfWI |
Name |
5-Methyl-1-phenylpyrimidine-2,4(1H,3H)-dione |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
202.074227568 u |
Formula |
C11H10N2O2 |
InChI |
InChI=1S/C11H10N2O2/c1-8-7-13(11(15)12-10(8)14)9-5-3-2-4-6-9/h2-7H,1H3,(H,12,14,15) |
InChIKey |
JFIGUZOJHCKWSU-UHFFFAOYSA-N |
Molecular Weight |
202.213 g/mol |
SMILES |
C=1(N2C(=O)NC(=O)C(C)=C2)C=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.981348 |