| SpectraBase Compound ID | CwotTwbuGcC |
|---|---|
| InChI | InChI=1S/C12H17NOS/c1-9(2)12(14)15-11-7-5-10(6-8-11)13(3)4/h5-9H,1-4H3 |
| InChIKey | LLDHOCBAJOABEN-UHFFFAOYSA-N |
| Mol Weight | 223.33 g/mol |
| Molecular Formula | C12H17NOS |
| Exact Mass | 223.103085 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JVmSDQMC9GW |
|---|---|
| Name | 4-(Dimethylamino)thiophenol, S-(2-methylpropionyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 223.103085344 u |
| Formula | C12H17NOS |
| InChI | InChI=1S/C12H17NOS/c1-9(2)12(14)15-11-7-5-10(6-8-11)13(3)4/h5-9H,1-4H3 |
| InChIKey | LLDHOCBAJOABEN-UHFFFAOYSA-N |
| Molecular Weight | 223.334 g/mol |
| SMILES | C1(SC(C(C)C)=O)=CC=C(C=C1)N(C)C |