![{[4-(p-chlorophenyl)-5-hydroxy-4H-1,2,4-triazol-3-yl]thio}acetonitrile, O-ester with O,O-diethyl phosphorothioate](/api/spectrum/Id5ewHplgzr/structure.png?h=300&w=458 "{[4-(p-chlorophenyl)-5-hydroxy-4H-1,2,4-triazol-3-yl]thio}acetonitrile, O-ester with O,O-diethyl phosphorothioate")
| SpectraBase Compound ID | G0iox4d0YJY |
|---|---|
| InChI | InChI=1S/C14H16ClN4O3PS2/c1-3-20-23(24,21-4-2)22-13-17-18-14(25-10-9-16)19(13)12-7-5-11(15)6-8-12/h5-8H,3-4,10H2,1-2H3 |
| InChIKey | QSVVARLCGOVTAM-UHFFFAOYSA-N |
| Mol Weight | 418.85 g/mol |
| Molecular Formula | C14H16ClN4O3PS2 |
| Exact Mass | 418.008997 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Id5ewHplgzr |
|---|---|
| Name | {[4-(p-chlorophenyl)-5-hydroxy-4H-1,2,4-triazol-3-yl]thio}acetonitrile, O-ester with O,O-diethyl phosphorothioate |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C14H16ClN4O3PS2 |
| InChI | InChI=1S/C14H16ClN4O3PS2/c1-3-20-23(24,21-4-2)22-13-17-18-14(25-10-9-16)19(13)12-7-5-11(15)6-8-12/h5-8H,3-4,10H2,1-2H3 |
| InChIKey | QSVVARLCGOVTAM-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 61098M |
| Solvent | CDCl3 |