| SpectraBase Compound ID | BA2vgFCvADk |
|---|---|
| InChI | InChI=1S/C16H16N2S/c19-16(17-14-9-2-1-3-10-14)18-12-6-8-13-7-4-5-11-15(13)18/h1-5,7,9-11H,6,8,12H2,(H,17,19) |
| InChIKey | SUWCZYTUBWQYIU-UHFFFAOYSA-N |
| Mol Weight | 268.38 g/mol |
| Molecular Formula | C16H16N2S |
| Exact Mass | 268.10342 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HQ330UAZfRK |
|---|---|
| Name | N-Phenyl-3,4-dihydro-2H-quinoline-1-carbothioamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 268.103419697 u |
| Formula | C16H16N2S |
| InChI | InChI=1S/C16H16N2S/c19-16(17-14-9-2-1-3-10-14)18-12-6-8-13-7-4-5-11-15(13)18/h1-5,7,9-11H,6,8,12H2,(H,17,19) |
| InChIKey | SUWCZYTUBWQYIU-UHFFFAOYSA-N |
| SMILES | C1CCC=2C(N1C(=S)NC1=CC=CC=C1)=CC=CC2 |