| SpectraBase Spectrum ID |
2r1n9UxGhvR |
| Name |
(E)-2-[(4-Fluorophenyl)(toluene-4-sulfonylamino)methyl]but-2-enoic acid phenyl ester |
| Alternate Name(s) |
phenyl (2E)-2-((4-fluorophenyl){[(4-methylphenyl)sulfonyl]amino}methyl)-2-butenoate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C24H22FNO4S |
| InChI |
InChI=1S/C24H22FNO4S/c1-3-22(24(27)30-20-7-5-4-6-8-20)23(18-11-13-19(25)14-12-18)26-31(28,29)21-15-9-17(2)10-16-21/h3-16,23,26H,1-2H3/b22-3+ |
| InChIKey |
XXQRCRWDSOHJHZ-HEQWTUPCSA-N |
| Molecular Weight |
439.501 g/mol |
| SMILES |
N(C(\C(C(=O)Oc1ccccc1)=C/C)c1ccc(cc1)F)S(=O)(=O)c1ccc(cc1)C |
| SPLASH |
splash10-0006-9000000000-63d7527861966ac92842 |
| Source of Spectrum |
F-62-468-4 |
| Wiley ID |
1631876 |
![(E)-2-[(4-Fluorophenyl)(toluene-4-sulfonylamino)methyl]but-2-enoic acid phenyl ester](/api/spectrum/2r1n9UxGhvR/structure.png?h=300&w=458 "(E)-2-[(4-Fluorophenyl)(toluene-4-sulfonylamino)methyl]but-2-enoic acid phenyl ester")
