| SpectraBase Compound ID | HRyQoD24b4G |
|---|---|
| InChI | InChI=1S/C12H13N3O4S/c1-17-8-4-7(5-9(18-2)10(8)19-3)11(16)14-12-15-13-6-20-12/h4-6H,1-3H3,(H,14,15,16) |
| InChIKey | HQQUZFIPJBWCSC-UHFFFAOYSA-N |
| Mol Weight | 295.31 g/mol |
| Molecular Formula | C12H13N3O4S |
| Exact Mass | 295.062677 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HBYJS5FKMnX |
|---|---|
| Name | 3,4,5-Trimethoxy-N-(1,3,4-thiadiazol-2-yl)benzamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 295.062677081 u |
| Formula | C12H13N3O4S |
| InChI | InChI=1S/C12H13N3O4S/c1-17-8-4-7(5-9(18-2)10(8)19-3)11(16)14-12-15-13-6-20-12/h4-6H,1-3H3,(H,14,15,16) |
| InChIKey | HQQUZFIPJBWCSC-UHFFFAOYSA-N |
| SMILES | N(C=1SC=NN1)C(C1=CC(OC)=C(C(=C1)OC)OC)=O |