| SpectraBase Compound ID | 8XYgCM8Fap1 |
|---|---|
| InChI | InChI=1S/C5H8S/c1-3-5-6-4-2/h1H,4-5H2,2H3 |
| InChIKey | HGRTUSIZMXOMCD-UHFFFAOYSA-N |
| Mol Weight | 100.18 g/mol |
| Molecular Formula | C5H8S |
| Exact Mass | 100.034671 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4YdSSwNC34H |
|---|---|
| Name | Propargyl ethyl sulfide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 100.034671432 u |
| Formula | C5H8S |
| InChI | InChI=1S/C5H8S/c1-3-5-6-4-2/h1H,4-5H2,2H3 |
| InChIKey | HGRTUSIZMXOMCD-UHFFFAOYSA-N |
| Molecular Weight | 100.179 g/mol |
| SMILES | C(CSCC)#C |