covnmr_predict_spectrum
Predict a realistic synthetic NMR spectrum from SMILES — multiplets (d/t/q…), J-couplings, and integrals, plus the coupling-resolved curve. Use for planning/comparison before measurement.
Input Schema
TableJSON Schema
| Name | Required | Description | Default |
|---|---|---|---|
| smiles | Yes | ||
| api_key | No | ||
| nucleus | No | 1H | |
| solvent | No | CDCl3 | |
| field_mhz | No |
Output Schema
TableJSON Schema
| Name | Required | Description | Default |
|---|---|---|---|
| result | Yes |