| SpectraBase Spectrum ID |
5UxAqTnEunD |
| Name |
2-(N-Mesyl-2-methoxycarbonylanilino)-6-phenyl-1,4-benzoquinone |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H17NO6S |
| InChI |
InChI=1S/C21H17NO6S/c1-28-21(25)16-10-6-7-11-18(16)22(29(2,26)27)19-13-15(23)12-17(20(19)24)14-8-4-3-5-9-14/h3-13H,1-2H3 |
| InChIKey |
CIDSCPCWCBFPOH-UHFFFAOYSA-N |
| Molecular Weight |
411.428 g/mol |
| SMILES |
C1(C(=CC(C=C1c1ccccc1)=O)N(c1c(cccc1)C(=O)OC)S(=O)(=O)C)=O |
| SPLASH |
splash10-001i-0009000000-4254262d3e3048cd5ddc |
| Source of Spectrum |
SO-0-679-18 |
| Synonyms |
methyl 2-[(3,6-dioxo-5-phenyl-1,4-cyclohexadien-1-yl)(methylsulfonyl)amino]benzoate |
| Wiley ID |
1544211 |
