| SpectraBase Compound ID | BiKGeB3nt8D |
|---|---|
| InChI | InChI=1S/C14H19NOS/c1-3-10-15(11-4-2)14(16)12-17-13-8-6-5-7-9-13/h3,5-9H,1,4,10-12H2,2H3 |
| InChIKey | GDUWISMQKCJZCG-UHFFFAOYSA-N |
| Mol Weight | 249.37 g/mol |
| Molecular Formula | C14H19NOS |
| Exact Mass | 249.118735 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IbJpqDnoYJW |
|---|---|
| Name | Acetamide, N-allyl-N-propyl-2-(phenylthio)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 249.118735409 u |
| Formula | C14H19NOS |
| InChI | InChI=1S/C14H19NOS/c1-3-10-15(11-4-2)14(16)12-17-13-8-6-5-7-9-13/h3,5-9H,1,4,10-12H2,2H3 |
| InChIKey | GDUWISMQKCJZCG-UHFFFAOYSA-N |
| Molecular Weight | 249.372 g/mol |
| SMILES | C(N(CCC)CC=C)(=O)CSC1=CC=CC=C1 |