| SpectraBase Compound ID | 3gkTuD9XkmA |
|---|---|
| InChI | InChI=1S/C18H13NO3S2/c1-22-14-9-7-13(8-10-14)16(20)19-17(21)15(24-18(19)23)11-12-5-3-2-4-6-12/h2-11H,1H3/b15-11+ |
| InChIKey | RNRCTMRSSLTLCD-RVDMUPIBSA-N |
| Mol Weight | 355.43 g/mol |
| Molecular Formula | C18H13NO3S2 |
| Exact Mass | 355.033686 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | K6GaJAJPYTG |
|---|---|
| Name | 5-Benzylidene-3-(4-methoxybenzoyl)rhodanine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 355.033685628 u |
| Formula | C18H13NO3S2 |
| InChI | InChI=1S/C18H13NO3S2/c1-22-14-9-7-13(8-10-14)16(20)19-17(21)15(24-18(19)23)11-12-5-3-2-4-6-12/h2-11H,1H3/b15-11+ |
| InChIKey | RNRCTMRSSLTLCD-RVDMUPIBSA-N |
| Molecular Weight | 355.426 g/mol |
| SMILES | C1(\C(SC(N1C(=O)c1ccc(cc1)OC)=S)=C/c1ccccc1)=O |