| SpectraBase Compound ID | Lbrt7p2rbph |
|---|---|
| InChI | InChI=1S/C10H10ClN5O2/c1-6(9(17)12-10-13-15-16-14-10)18-8-4-2-3-7(11)5-8/h2-6H,1H3,(H2,12,13,14,15,16,17) |
| InChIKey | ADJQRCCHYLEHEK-UHFFFAOYSA-N |
| Mol Weight | 267.68 g/mol |
| Molecular Formula | C10H10ClN5O2 |
| Exact Mass | 267.052302 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3mX3hFRpe3g |
|---|---|
| Name | 2-(3-Chlorophenoxy)-N-(1H-tetraazol-5-yl)propanamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 267.052302280 u |
| Formula | C10H10ClN5O2 |
| InChI | InChI=1S/C10H10ClN5O2/c1-6(9(17)12-10-13-15-16-14-10)18-8-4-2-3-7(11)5-8/h2-6H,1H3,(H2,12,13,14,15,16,17) |
| InChIKey | ADJQRCCHYLEHEK-UHFFFAOYSA-N |
| SMILES | N1C(=NN=N1)NC(C(OC1=CC(Cl)=CC=C1)C)=O |