![2-{[5-(p-tert-butylphenyl)-4-methyl-4H-1,2,4-triazol-3-yl]thio}-o-(p-nitrobenzoyl)acetamidoxime](/api/spectrum/49wtbVsBNVA/structure.png?h=300&w=458 "2-{[5-(p-tert-butylphenyl)-4-methyl-4H-1,2,4-triazol-3-yl]thio}-o-(p-nitrobenzoyl)acetamidoxime")
| SpectraBase Compound ID | 1qBtCiNQR9P |
|---|---|
| InChI | InChI=1S/C22H24N6O4S/c1-22(2,3)16-9-5-14(6-10-16)19-24-25-21(27(19)4)33-13-18(23)26-32-20(29)15-7-11-17(12-8-15)28(30)31/h5-12H,13H2,1-4H3,(H2,23,26) |
| InChIKey | GCEMLGAASZFJRI-UHFFFAOYSA-N |
| Mol Weight | 468.53 g/mol |
| Molecular Formula | C22H24N6O4S |
| Exact Mass | 468.157974 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 49wtbVsBNVA |
|---|---|
| Name | 2-{[5-(p-tert-butylphenyl)-4-methyl-4H-1,2,4-triazol-3-yl]thio}-o-(p-nitrobenzoyl)acetamidoxime |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H24N6O4S |
| InChI | InChI=1S/C22H24N6O4S/c1-22(2,3)16-9-5-14(6-10-16)19-24-25-21(27(19)4)33-13-18(23)26-32-20(29)15-7-11-17(12-8-15)28(30)31/h5-12H,13H2,1-4H3,(H2,23,26) |
| InChIKey | GCEMLGAASZFJRI-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 46505M |
| Solvent | DMSO-d6 |