| SpectraBase Compound ID | LmyPeRttx5E |
|---|---|
| InChI | InChI=1S/C12H13O2.3CH3.Sn/c1-2-10-14-12(13)9-8-11-6-4-3-5-7-11;;;;/h2-8H,1,9-10H2;3*1H3; |
| InChIKey | MLAKQKOLPZTZKN-UHFFFAOYSA-N |
| Mol Weight | 353.05 g/mol |
| Molecular Formula | C15H22O2Sn |
| Exact Mass | 354.064182 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KgbKrxWGv64 |
|---|---|
| Name | Benzenepropanoic acid, .beta.-(trimethylstannyl)-, 2-propenyl ester, (.+-.)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 354.064181946 u |
| Formula | C15H22O2Sn |
| InChI | InChI=1S/C12H13O2.3CH3.Sn/c1-2-10-14-12(13)9-8-11-6-4-3-5-7-11;;;;/h2-8H,1,9-10H2;3*1H3; |
| InChIKey | MLAKQKOLPZTZKN-UHFFFAOYSA-N |
| Molecular Weight | 353.050 g/mol |
| SMILES | C(C([Sn](C)(C)C)C=1C=CC=CC1)C(=O)OCC=C |