Current SMILES String

CCOC(=O)[C@@H](CCC1=CC=CC=C1)O

Solvent: CCl3

Chemical Shift Scatterplot

SMILES Image

The rendered SMILES image for the query string.

Query Model

Enter a SMILES String to see Predictions

Model Predictions and Ground Truth

The model predictions from the SMILES Query

Please log in or register to see model observations in tabular format.