| SpectraBase Compound ID | 4H9YAl9nOWC |
|---|---|
| InChI | InChI=1S/C13H12O5S/c14-19(15)17-9-11(18-19)8-16-13-7-3-5-10-4-1-2-6-12(10)13/h1-7,11H,8-9H2/t11-/m0/s1 |
| InChIKey | QSIJZSXNOQOXBY-NSHDSACASA-N |
| Mol Weight | 280.29 g/mol |
| Molecular Formula | C13H12O5S |
| Exact Mass | 280.040545 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IbTR3l0W0Pe |
|---|---|
| Name | (4S)-4-(1-Naphthoxymethyl)-1,3,2-dioxathiolane-2,2-dioxide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 280.040544655 u |
| Formula | C13H12O5S |
| InChI | InChI=1S/C13H12O5S/c14-19(15)17-9-11(18-19)8-16-13-7-3-5-10-4-1-2-6-12(10)13/h1-7,11H,8-9H2/t11-/m0/s1 |
| InChIKey | QSIJZSXNOQOXBY-NSHDSACASA-N |
| Molecular Weight | 280.294 g/mol |
| SMILES | [C@@]1(OS(OC1)(=O)=O)(COC1=C2C(C=CC=C2)=CC=C1)[H] |