317E-20.
Dataset description:
This dataset contains NMR spectra obtained for the sample -317E-20 name: PROTON_01.fid phc0: -139.161300659 isFid: true nucleus: 1H solvent: dmso dimension: 1 isComplex: true temperature:...
Source: 317E-20.
Chemical Info
| InChI | InChI=1S/C15H15N3O3S/c1-22-15-6-9-8-4-2-3-5-10(8)16-11(9)14(7-19,12(20)18-15)17-13(15)21/h2-5,16,19H,6-7H2,1H3,(H,17,21)(H,18,20)/t14-,15+/m1/s1 |
|---|---|
| SMILES | CS[C@@]12CC3=C(NC4=C3C=CC=C4)[C@@](CO)(NC1=O)C(=O)N2 |
| InChI Key | GQQXRZALBWBSBI-CABCVRRESA-N |
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Additional Information
| Field | Value |
|---|---|
| Data last updated | February 3, 2025 |
| Metadata last updated | February 3, 2025 |
| Created | February 3, 2025 |
| Format | HTML |
| License | Attribution-ShareAlike 4.0 International |
| Id | 11b5ac88-c4c1-4b72-927b-52f9af211dd3 |
| Package id | nmrxiv-d2465 |
| Resource type | HTML |
| State | active |