| SpectraBase Spectrum ID |
5yTjXiV9zLl |
| Name |
(E)-2-[(4-Fluorophenyl)(toluene-4-sulfonylamino)methyl]penta-2,4-dienoic acid phenyl ester |
| Alternate Name(s) |
phenyl (2E)-2-((4-fluorophenyl){[(4-methylphenyl)sulfonyl]amino}methyl)-2,4-pentadienoate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H22FNO4S |
| InChI |
InChI=1S/C25H22FNO4S/c1-3-7-23(25(28)31-21-8-5-4-6-9-21)24(19-12-14-20(26)15-13-19)27-32(29,30)22-16-10-18(2)11-17-22/h3-17,24,27H,1H2,2H3/b23-7+ |
| InChIKey |
XLWWPKYCGCKUNC-HCGXMYGOSA-N |
| Molecular Weight |
451.512 g/mol |
| SMILES |
N(C(\C(C(=O)Oc1ccccc1)=C/C=C)c1ccc(cc1)F)S(=O)(=O)c1ccc(cc1)C |
| SPLASH |
splash10-0006-9000000000-57c7670a309a8a4fe8a5 |
| Source of Spectrum |
F-62-473-8 |
| Wiley ID |
1631851 |
![(E)-2-[(4-Fluorophenyl)(toluene-4-sulfonylamino)methyl]penta-2,4-dienoic acid phenyl ester](/api/spectrum/5yTjXiV9zLl/structure.png?h=300&w=458 "(E)-2-[(4-Fluorophenyl)(toluene-4-sulfonylamino)methyl]penta-2,4-dienoic acid phenyl ester")
