| SpectraBase Spectrum ID |
DIl4cJZnan4 |
| Name |
(E)-1-(4-methoxyphenyl)-2-tosylpent-2-ene-1,4-dione |
| Alternate Name(s) |
(2E)-1-(4-methoxyphenyl)-2-[(4-methylphenyl)sulfonyl]-2-pentene-1,4-dione |
| CAS Registry Number |
115563-25-2 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H18O5S |
| InChI |
InChI=1S/C19H18O5S/c1-13-4-10-17(11-5-13)25(22,23)18(12-14(2)20)19(21)15-6-8-16(24-3)9-7-15/h4-12H,1-3H3/b18-12+ |
| InChIKey |
MPDAJMMOVVSVRZ-LDADJPATSA-N |
| Molecular Weight |
358.408 g/mol |
| SMILES |
c1(S(\C(C(c2ccc(cc2)OC)=O)=C/C(=O)C)(=O)=O)ccc(cc1)C |
| SPLASH |
splash10-000i-0900000000-a191c217807d1a87cdc8 |
| Source of Spectrum |
J-53-4715-27 |
| Wiley ID |
1346953 |
