| SpectraBase Compound ID | 993zcDVfSCy |
|---|---|
| InChI | InChI=1S/C8H13O2.3C6H5.Sn/c1-3-4-5-6-7-8(9)10-2;3*1-2-4-6-5-3-1;/h6H,3-5H2,1-2H3;3*1-5H; |
| InChIKey | RZQQVUJXXXMKKL-UHFFFAOYSA-N |
| Mol Weight | 491.22 g/mol |
| Molecular Formula | C26H28O2Sn |
| Exact Mass | 492.111132 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ex4UvNlScdN |
|---|---|
| Name | (Z)-2-Triphenylstannyl-2-heptenoic acid methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 492.111132140 u |
| Formula | C26H28O2Sn |
| InChI | InChI=1S/C8H13O2.3C6H5.Sn/c1-3-4-5-6-7-8(9)10-2;3*1-2-4-6-5-3-1;/h6H,3-5H2,1-2H3;3*1-5H; |
| InChIKey | RZQQVUJXXXMKKL-UHFFFAOYSA-N |
| Molecular Weight | 491.219 g/mol |
| SMILES | C=1([Sn](\C(C(=O)OC)=C/CCCC)(C=2C=CC=CC2)C=2C=CC=CC2)C=CC=CC1 |