| SpectraBase Compound ID | DjffV7NauXc |
|---|---|
| InChI | InChI=1S/C12H15NOS/c15-12(13-9-5-2-6-10-13)14-11-7-3-1-4-8-11/h1,3-4,7-8H,2,5-6,9-10H2 |
| InChIKey | TVWGACPYJWIWPY-UHFFFAOYSA-N |
| Mol Weight | 221.32 g/mol |
| Molecular Formula | C12H15NOS |
| Exact Mass | 221.087435 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Es54NJGpsOd |
|---|---|
| Name | o-Phenyl piperidine-1-carbothioate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 221.087435280 u |
| Formula | C12H15NOS |
| InChI | InChI=1S/C12H15NOS/c15-12(13-9-5-2-6-10-13)14-11-7-3-1-4-8-11/h1,3-4,7-8H,2,5-6,9-10H2 |
| InChIKey | TVWGACPYJWIWPY-UHFFFAOYSA-N |
| Molecular Weight | 221.318 g/mol |
| SMILES | C(N1CCCCC1)(OC=1C=CC=CC1)=S |