![2-{{[5-chloro-1-(p-chlorophenyl)-1H-1,2,3-triazol-4-yl]methyl}thio}-6-propyl-4-pyrimidinol](/api/spectrum/7kRolpyEJ5c/structure.png?h=300&w=458 "2-{{[5-chloro-1-(p-chlorophenyl)-1H-1,2,3-triazol-4-yl]methyl}thio}-6-propyl-4-pyrimidinol")
| SpectraBase Compound ID | 1IVqAKDjKUQ |
|---|---|
| InChI | InChI=1S/C16H15Cl2N5OS/c1-2-3-11-8-14(24)20-16(19-11)25-9-13-15(18)23(22-21-13)12-6-4-10(17)5-7-12/h4-8H,2-3,9H2,1H3,(H,19,20,24) |
| InChIKey | ZEKCOMVPOUBXCF-UHFFFAOYSA-N |
| Mol Weight | 396.3 g/mol |
| Molecular Formula | C16H15Cl2N5OS |
| Exact Mass | 395.037437 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7kRolpyEJ5c |
|---|---|
| Name | 2-{{[5-chloro-1-(p-chlorophenyl)-1H-1,2,3-triazol-4-yl]methyl}thio}-6-propyl-4-pyrimidinol |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H15Cl2N5OS |
| InChI | InChI=1S/C16H15Cl2N5OS/c1-2-3-11-8-14(24)20-16(19-11)25-9-13-15(18)23(22-21-13)12-6-4-10(17)5-7-12/h4-8H,2-3,9H2,1H3,(H,19,20,24) |
| InChIKey | ZEKCOMVPOUBXCF-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 58277M |
| Solvent | CDCl3 |