| SpectraBase Compound ID | 1RoElSf2L3z |
|---|---|
| InChI | InChI=1S/C13H17NO2S/c15-13(14-9-11-5-4-8-16-11)10-17-12-6-2-1-3-7-12/h1-3,6-7,11H,4-5,8-10H2,(H,14,15) |
| InChIKey | HYFXXCQTXREDNT-UHFFFAOYSA-N |
| Mol Weight | 251.34 g/mol |
| Molecular Formula | C13H17NO2S |
| Exact Mass | 251.098 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DI4iez94pnu |
|---|---|
| Name | Acetamide, N-tetrahydrofurfuryl-2-phenylthio- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 251.097999963 u |
| Formula | C13H17NO2S |
| InChI | InChI=1S/C13H17NO2S/c15-13(14-9-11-5-4-8-16-11)10-17-12-6-2-1-3-7-12/h1-3,6-7,11H,4-5,8-10H2,(H,14,15) |
| InChIKey | HYFXXCQTXREDNT-UHFFFAOYSA-N |
| Molecular Weight | 251.344 g/mol |
| SMILES | C1=C(C=CC=C1)SCC(NCC1CCCO1)=O |