![4-[6-chloro-2-(methylamino)-5-(methylthio)-4-pyrimidinyl]-1-piperazineethanol](/api/spectrum/Dm8QnlRRINL/structure.png?h=300&w=458 "4-[6-chloro-2-(methylamino)-5-(methylthio)-4-pyrimidinyl]-1-piperazineethanol")
| SpectraBase Compound ID | 2YJnbOWrbXq |
|---|---|
| InChI | InChI=1S/C12H20ClN5OS/c1-14-12-15-10(13)9(20-2)11(16-12)18-5-3-17(4-6-18)7-8-19/h19H,3-8H2,1-2H3,(H,14,15,16) |
| InChIKey | RGXCCTUBFMDKJO-UHFFFAOYSA-N |
| Mol Weight | 317.84 g/mol |
| Molecular Formula | C12H20ClN5OS |
| Exact Mass | 317.107709 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Dm8QnlRRINL |
|---|---|
| Name | 4-[6-chloro-2-(methylamino)-5-(methylthio)-4-pyrimidinyl]-1-piperazineethanol |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H20ClN5OS |
| InChI | InChI=1S/C12H20ClN5OS/c1-14-12-15-10(13)9(20-2)11(16-12)18-5-3-17(4-6-18)7-8-19/h19H,3-8H2,1-2H3,(H,14,15,16) |
| InChIKey | RGXCCTUBFMDKJO-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 26327M |
| Solvent | CDCl3 |