| SpectraBase Spectrum ID |
WERglB58RC |
| Name |
Methyl (E)-2-[1-hydroxy-1-(4-nitrophenyl)methyl]-3-methylsulfanyl acrylate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H13NO5S |
| InChI |
InChI=1S/C12H13NO5S/c1-18-12(15)10(7-19-2)11(14)8-3-5-9(6-4-8)13(16)17/h3-7,11,14H,1-2H3/b10-7+ |
| InChIKey |
MKYPRHZWFGHNFK-JXMROGBWSA-N |
| Molecular Weight |
283.298 g/mol |
| SMILES |
OC(\C(C(=O)OC)=C/SC)c1ccc(N(=O)=O)cc1 |
| SPLASH |
splash10-000i-0090000000-cae6d3744999eff89204 |
| Source of Spectrum |
QF-9-1501-9 |
| Synonyms |
methyl (2E)-2-[hydroxy(4-nitrophenyl)methyl]-3-(methylsulfanyl)-2-propenoate |
| Wiley ID |
1558276 |
![Methyl (E)-2-[1-hydroxy-1-(4-nitrophenyl)methyl]-3-methylsulfanyl acrylate](/api/spectrum/WERglB58RC/structure.png?h=300&w=458 "Methyl (E)-2-[1-hydroxy-1-(4-nitrophenyl)methyl]-3-methylsulfanyl acrylate")
