| SpectraBase Spectrum ID |
9xKAixTDFVt |
| Name |
2-[(acetylthio)methyl]pyrimidine-4,5-dicarboxylic acid dimethyl ester |
| Alternate Name(s) |
dimethyl 2-(acetylsulfanylmethyl)pyrimidine-4,5-dicarboxylate
dimethyl 2-(ethanoylsulfanylmethyl)pyrimidine-4,5-dicarboxylate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H12N2O5S |
| InChI |
InChI=1S/C11H12N2O5S/c1-6(14)19-5-8-12-4-7(10(15)17-2)9(13-8)11(16)18-3/h4H,5H2,1-3H3 |
| InChIKey |
CURYRZSEEMHJLQ-UHFFFAOYSA-N |
| Molecular Weight |
284.286 g/mol |
| SMILES |
c1(nc(c(cn1)C(=O)OC)C(=O)OC)CSC(=O)C |
| SPLASH |
splash10-0006-0090000000-0a5cd5a4c27a9e56c3e9 |
| Source of Spectrum |
C5-2003-2767-2 |
| Wiley ID |
1616212 |
![2-[(acetylthio)methyl]pyrimidine-4,5-dicarboxylic acid dimethyl ester](/api/spectrum/9xKAixTDFVt/structure.png?h=300&w=458 "2-[(acetylthio)methyl]pyrimidine-4,5-dicarboxylic acid dimethyl ester")
