![t-Butyl (E)-[3-(thiophen-3'-yl)prop-2-en-1-yl]-carbonate]](/api/spectrum/5qmQo8z2HSt/structure.png?h=300&w=458 "t-Butyl (E)-[3-(thiophen-3'-yl)prop-2-en-1-yl]-carbonate]")
| SpectraBase Compound ID | CCOzYySQyYY |
|---|---|
| InChI | InChI=1S/C12H16O3S/c1-12(2,3)15-11(13)14-7-4-5-10-6-8-16-9-10/h4-6,8-9H,7H2,1-3H3/b5-4+ |
| InChIKey | OTABEFFBXVBKBU-SNAWJCMRSA-N |
| Mol Weight | 240.32 g/mol |
| Molecular Formula | C12H16O3S |
| Exact Mass | 240.082016 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5qmQo8z2HSt |
|---|---|
| Name | T-Butyl (E)-[3-(thiophen-3'-yl)prop-2-en-1-yl]-carbonate] |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 240.082015546 u |
| Formula | C12H16O3S |
| InChI | InChI=1S/C12H16O3S/c1-12(2,3)15-11(13)14-7-4-5-10-6-8-16-9-10/h4-6,8-9H,7H2,1-3H3/b5-4+ |
| InChIKey | OTABEFFBXVBKBU-SNAWJCMRSA-N |
| Molecular Weight | 240.317 g/mol |
| SMILES | C(OC(C)(C)C)(=O)OC\C=C\C1=CSC=C1 |