| SpectraBase Compound ID | 1AYMtcR5353 |
|---|---|
| InChI | InChI=1S/C6H13N3O2/c1-5(2)11-6(10)7-8-9(3)4/h5H,1-4H3/b8-7+ |
| InChIKey | ZKOYFGLKAKSLII-BQYQJAHWSA-N |
| Mol Weight | 159.19 g/mol |
| Molecular Formula | C6H13N3O2 |
| Exact Mass | 159.100777 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5Z0CpmlaXAG |
|---|---|
| Name | 1-Triazene-1-carboxylic acid, 3,3-dimethyl-, 1-methylethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 159.100776669 u |
| Formula | C6H13N3O2 |
| InChI | InChI=1S/C6H13N3O2/c1-5(2)11-6(10)7-8-9(3)4/h5H,1-4H3/b8-7+ |
| InChIKey | ZKOYFGLKAKSLII-BQYQJAHWSA-N |
| SMILES | CN(\N=N\C(=O)OC(C)C)C |