| SpectraBase Compound ID | JQLpQqD4sFE |
|---|---|
| InChI | InChI=1S/C15H15NOS/c16-14(17)11-18-15(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10,15H,11H2,(H2,16,17) |
| InChIKey | HCRQRIFRHGPWBH-UHFFFAOYSA-N |
| Mol Weight | 257.35 g/mol |
| Molecular Formula | C15H15NOS |
| Exact Mass | 257.087435 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HoajcnsmcuX |
|---|---|
| Name | Deoxymodafinil |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 257.087435280 u |
| Formula | C15H15NOS |
| InChI | InChI=1S/C15H15NOS/c16-14(17)11-18-15(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10,15H,11H2,(H2,16,17) |
| InChIKey | HCRQRIFRHGPWBH-UHFFFAOYSA-N |
| Molecular Weight | 257.351 g/mol |
| SMILES | C(C=1C=CC=CC1)(C1=CC=CC=C1)SCC(=O)N |