| SpectraBase Compound ID | IC2BTDpITLR |
|---|---|
| InChI | InChI=1S/C4H6N4O2/c1-10-4(9)2-8-3-5-6-7-8/h3H,2H2,1H3 |
| InChIKey | CGQJVEFCNZKVRS-UHFFFAOYSA-N |
| Mol Weight | 142.12 g/mol |
| Molecular Formula | C4H6N4O2 |
| Exact Mass | 142.049075 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FY1QapTOh1r |
|---|---|
| Name | 2-(1-Tetrazolyl)acetic acid methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 142.049075447 u |
| Formula | C4H6N4O2 |
| InChI | InChI=1S/C4H6N4O2/c1-10-4(9)2-8-3-5-6-7-8/h3H,2H2,1H3 |
| InChIKey | CGQJVEFCNZKVRS-UHFFFAOYSA-N |
| SMILES | C(N1N=NN=C1)C(=O)OC |