| SpectraBase Compound ID | 1CV8vjh0rq0 |
|---|---|
| InChI | InChI=1S/C9H11N3O/c1-7(13)6-12-9-5-3-2-4-8(9)10-11-12/h2-5,7,13H,6H2,1H3/t7-/m0/s1 |
| InChIKey | VGIQZFVQVQAEAZ-ZETCQYMHSA-N |
| Mol Weight | 177.21 g/mol |
| Molecular Formula | C9H11N3O |
| Exact Mass | 177.090212 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3GWKZpr77lj |
|---|---|
| Name | (2S)-1-(1-Benzotriazolyl)-2-propanol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 177.090211985 u |
| Formula | C9H11N3O |
| InChI | InChI=1S/C9H11N3O/c1-7(13)6-12-9-5-3-2-4-8(9)10-11-12/h2-5,7,13H,6H2,1H3/t7-/m0/s1 |
| InChIKey | VGIQZFVQVQAEAZ-ZETCQYMHSA-N |
| Molecular Weight | 177.207 g/mol |
| SMILES | C1=2N(N=NC1=CC=CC2)C[C@@](O)(C)[H] |