Molecule
13C nuclear magnetic resonance spectroscopy (13C NMR)
1H nuclear magnetic resonance spectroscopy (1H NMR)
infrared absorption spectroscopy (IR)
mass spectrometry (MS)
X-ray diffraction (XRD)
1-bicyclo[1.1.1]pentanyl-imino-(4-nitrophenyl)-oxo-lambda6-sulfane
Chemical Information
| InChI | InChI=1S/C11H12N2O3S/c12-17(16,11-5-8(6-11)7-11)10-3-1-9(2-4-10)13(14)15/h1-4,8,12H,5-7H2 |
|---|---|
| SMILES | N=S(=O)(C12CC(C1)C2)c1ccc(cc1)[N+](=O)[O-] |
| InChI Key | YKKIPCONLLTXMO-UHFFFAOYSA-N |
| Exact Mass | 252.290 g/mol |
5 Related Dataset(s)
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Metadata Information
| Field | Value |
|---|---|
| NFDI4Chem Molecule ID | nfdi4chem-mol1058 |
| Source | |
| Alternate Name |
| Field | Value |
|---|---|
| No additional information available for this Dataset. | |
| Data-Source Molecule ID | Data-Source |
|---|---|
| 145926373 | pubchem |
| The data in this table is sourced from UniChem at EBI. | |