| SpectraBase Compound ID | DNz7BgSZJ27 |
|---|---|
| InChI | InChI=1S/C13H19NOS/c1-11(2)8-9-14-13(15)10-16-12-6-4-3-5-7-12/h3-7,11H,8-10H2,1-2H3,(H,14,15) |
| InChIKey | QPMJETSYOJEYMZ-UHFFFAOYSA-N |
| Mol Weight | 237.36 g/mol |
| Molecular Formula | C13H19NOS |
| Exact Mass | 237.118735 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | J85dOQcYWEK |
|---|---|
| Name | Acetamide, 2-phenylthio-N-3-methylbutyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 237.118735409 u |
| Formula | C13H19NOS |
| InChI | InChI=1S/C13H19NOS/c1-11(2)8-9-14-13(15)10-16-12-6-4-3-5-7-12/h3-7,11H,8-10H2,1-2H3,(H,14,15) |
| InChIKey | QPMJETSYOJEYMZ-UHFFFAOYSA-N |
| Molecular Weight | 237.361 g/mol |
| SMILES | C(=O)(NCCC(C)C)CSC1=CC=CC=C1 |