| SpectraBase Compound ID | KRpkzJ7Wd4h |
|---|---|
| InChI | InChI=1S/C12H10N2O2S/c1-9-5-6-17-12(9)8-13-10-3-2-4-11(7-10)14(15)16/h2-8H,1H3/b13-8+ |
| InChIKey | ODIGUMXKNCMWMF-MDWZMJQESA-N |
| Mol Weight | 246.28 g/mol |
| Molecular Formula | C12H10N2O2S |
| Exact Mass | 246.046299 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CXZvZ1S7u51 |
|---|---|
| Name | Thiophene, 2-(3-nitrophenyliminomethyl)-3-methyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 246.046298742 u |
| Formula | C12H10N2O2S |
| InChI | InChI=1S/C12H10N2O2S/c1-9-5-6-17-12(9)8-13-10-3-2-4-11(7-10)14(15)16/h2-8H,1H3/b13-8+ |
| InChIKey | ODIGUMXKNCMWMF-MDWZMJQESA-N |
| Molecular Weight | 246.284 g/mol |
| SMILES | C1=CC=C(N(=O)=O)C=C1\N=C\C1=C(C=CS1)C |