| SpectraBase Compound ID | 8LuSuBvDKOO |
|---|---|
| InChI | InChI=1S/C13H18O4S/c1-3-12(17-11-16-2)9-10-18(14,15)13-7-5-4-6-8-13/h4-10,12H,3,11H2,1-2H3/b10-9+/t12-/m0/s1 |
| InChIKey | DLOMHAROGQNCBY-VMPCVLLUSA-N |
| Mol Weight | 270.34 g/mol |
| Molecular Formula | C13H18O4S |
| Exact Mass | 270.09258 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LrKlsqQa0Vp |
|---|---|
| Name | (S)-1-(Phenylsulfonyl)-3-(methoxymethoxy)-1-pentene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 270.092580230 u |
| Formula | C13H18O4S |
| InChI | InChI=1S/C13H18O4S/c1-3-12(17-11-16-2)9-10-18(14,15)13-7-5-4-6-8-13/h4-10,12H,3,11H2,1-2H3/b10-9+/t12-/m0/s1 |
| InChIKey | DLOMHAROGQNCBY-VMPCVLLUSA-N |
| Molecular Weight | 270.343 g/mol |
| SMILES | [C@@](\C=C\S(=O)(=O)C=1C=CC=CC1)(OCOC)(CC)[H] |