SpectraBase Spectrum ID |
5GYPTroEiwp |
Name |
Ethanone, 1-phenyl-2-(1,2,3,4-tetrahydro-2-hydroxy-4-pyrimidinyl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
218.105527697 u |
Formula |
C12H14N2O2 |
InChI |
InChI=1S/C12H14N2O2/c15-11(9-4-2-1-3-5-9)8-10-6-7-13-12(16)14-10/h1-7,10,12-14,16H,8H2 |
InChIKey |
GPDQNIHNXJXCBQ-UHFFFAOYSA-N |
Molecular Weight |
218.256 g/mol |
SMILES |
C1(NC(C=CN1)CC(=O)C1=CC=CC=C1)O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.955504 |