SpectraBase Spectrum ID |
K2fHl8zAxpL |
Name |
5,6-Dihydro-6-methyl-2-phenylfuro[2,3-D]pyrimidin-4(3H)-one |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
228.089877632 u |
Formula |
C13H12N2O2 |
InChI |
InChI=1S/C13H12N2O2/c1-8-7-10-12(16)14-11(15-13(10)17-8)9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H,14,15,16) |
InChIKey |
ZQOWNKCTBASKPH-UHFFFAOYSA-N |
Molecular Weight |
228.251 g/mol |
SMILES |
N1C(C=2CC(OC2N=C1C=1C=CC=CC1)C)=O |
Spectrum/Structure Validation Score (Raman) |
0.870427 |