| SpectraBase Compound ID | ANIRYvN31Qu |
|---|---|
| InChI | InChI=1S/C16H13N3OS/c1-21-12-8-6-11(7-9-12)10-17-19-15-13-4-2-3-5-14(13)18-16(15)20/h2-10H,1H3,(H,18,19,20)/b17-10+ |
| InChIKey | UAJGCGFVRSIVEX-LICLKQGHSA-N |
| Mol Weight | 295.36 g/mol |
| Molecular Formula | C16H13N3OS |
| Exact Mass | 295.077933 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | NH8MmhtVsW |
|---|---|
| Name | Indole-2,3-dione, 3-(4-methylthiobenzylidene)hydrazone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 295.077933224 u |
| Formula | C16H13N3OS |
| InChI | InChI=1S/C16H13N3OS/c1-21-12-8-6-11(7-9-12)10-17-19-15-13-4-2-3-5-14(13)18-16(15)20/h2-10H,1H3,(H,18,19,20)/b17-10+ |
| InChIKey | UAJGCGFVRSIVEX-LICLKQGHSA-N |
| SMILES | C1(\C(C=2C(N1)=CC=CC2)=N/N=C/C=1C=CC(SC)=CC1)=O |