Strychnine.apt
Dataset description:
This dataset contains NMR spectra obtained for the sample -Strychnine date: 2008-05-06T11:27:15.000Z isFt: true name: Strychnine/2 phc0: -62 phc1: 0 type: NMR FID DECIM: 6 aqMod: 1 isFid:...
Source: Strychnine.apt
Chemical Info
| InChI | InChI=1S/C21H22N2O2/c24-18-10-16-19-13-9-17-21(6-7-22(17)11-12(13)5-8-25-16)14-3-1-2-4-15(14)23(18)20(19)21/h1-5,13,16-17,19-20H,6-11H2/t13-,16-,17-,19-,20-,21+/m1/s1 |
|---|---|
| SMILES | O=C1C[C@H]2OCC=C3CN4CC[C@@]56C7=CC=CC=C7N1[C@@H]5[C@@H]2[C@@H]3C[C@@H]46 |
| InChI Key | QMGVPVSNSZLJIA-KGSDWGHESA-N |
| Molecular Formula | C21H22N2O2 |
| Exact Mass | 334.400 g/mol |
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Additional Information
| Field | Value |
|---|---|
| Data last updated | April 22, 2024 |
| Metadata last updated | April 22, 2024 |
| Created | April 22, 2024 |
| Format | HTML |
| License | Attribution 4.0 International |
| Id | 3cb5e0d9-a432-4128-8a7c-4cf76fc4d921 |
| Package id | nmrxiv-d1414 |
| Resource type | HTML |
| State | active |