SpectraBase Compound ID | 4xwZR0Ln2sx |
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InChI | InChI=1S/C13H11ClN2O2S2/c1-7-3-4-8(14)5-9(7)20-10-6-15-13(19-2)16-11(10)12(17)18/h3-6H,1-2H3,(H,17,18) |
InChIKey | XBOCVROJOWLTMA-UHFFFAOYSA-N |
Mol Weight | 326.82 g/mol |
Molecular Formula | C13H11ClN2O2S2 |
Exact Mass | 325.995048 g/mol |
SpectraBase Spectrum ID | KP4kH5s7LKQ |
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Name | 5-[(5-chloro-o-tolyl)thio]-2-(methylthio)-4-pyrimidinecarboxylic acid |
Conditions | Basic |
Copyright | Copyright © 2008-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C13H11ClN2O2S2 |
InChI | InChI=1S/C13H11ClN2O2S2/c1-7-3-4-8(14)5-9(7)20-10-6-15-13(19-2)16-11(10)12(17)18/h3-6H,1-2H3,(H,17,18) |
InChIKey | XBOCVROJOWLTMA-UHFFFAOYSA-N |
Sadtler IR Number | 36552 |
Sadtler UV Number | 37291B |
Solvent | Methanol |