![tert-butyl 3-[2-[6-(trifluoromethylsulfonylamino)cyclohexen-1-yl]phenyl]prop-2-enoate](/api/spectrum/9ZygIsbkh3C/structure.png?h=300&w=458 "tert-butyl 3-[2-[6-(trifluoromethylsulfonylamino)cyclohexen-1-yl]phenyl]prop-2-enoate")
| SpectraBase Compound ID | AwMNWLjRYre |
|---|---|
| InChI | InChI=1S/C20H24F3NO4S/c1-19(2,3)28-18(25)13-12-14-8-4-5-9-15(14)16-10-6-7-11-17(16)24-29(26,27)20(21,22)23/h4-5,8-10,12-13,17,24H,6-7,11H2,1-3H3 |
| InChIKey | AWGSTYYLWYYOFM-UHFFFAOYSA-N |
| Mol Weight | 431.47 g/mol |
| Molecular Formula | C20H24F3NO4S |
| Exact Mass | 431.137814 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 9ZygIsbkh3C |
|---|---|
| Name | tert-butyl 3-[2-[6-(trifluoromethylsulfonylamino)cyclohexen-1-yl]phenyl]prop-2-enoate |
| Appearance | Viscous oil |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H24F3NO4S |
| InChI | InChI=1S/C20H24F3NO4S/c1-19(2,3)28-18(25)13-12-14-8-4-5-9-15(14)16-10-6-7-11-17(16)24-29(26,27)20(21,22)23/h4-5,8-10,12-13,17,24H,6-7,11H2,1-3H3 |
| InChIKey | AWGSTYYLWYYOFM-UHFFFAOYSA-N |
| Instrument Name | Hewlett-Packard 5971 |
| Ionization Type | EI |
| Literature Reference DOI | 10.1002/adsc.202101329 |
| Molecular Weight | 431.470 g/mol |
| SMILES | N(C1C(c2ccccc2C=CC(OC(C)(C)C)=O)=CCCC1)S(C(F)(F)F)(=O)=O |
| SPLASH | splash10-0560-6931000000-ab628f2e26c8f78acaec |
| Source of Spectrum | ASC-364-SM13-7a |
| Wiley ID | 1868619 |