| SpectraBase Compound ID | LJaTfJrRCeX |
|---|---|
| InChI | InChI=1S/C9H9N3O/c1-7(13)6-12-9-5-3-2-4-8(9)10-11-12/h2-5H,6H2,1H3 |
| InChIKey | NSVFTILUWQOBDA-UHFFFAOYSA-N |
| Mol Weight | 175.19 g/mol |
| Molecular Formula | C9H9N3O |
| Exact Mass | 175.074562 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | EwFsx3ZESzA |
|---|---|
| Name | Propan-2-one, 1-(1-benzotriazolyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 175.074561921 u |
| Formula | C9H9N3O |
| InChI | InChI=1S/C9H9N3O/c1-7(13)6-12-9-5-3-2-4-8(9)10-11-12/h2-5H,6H2,1H3 |
| InChIKey | NSVFTILUWQOBDA-UHFFFAOYSA-N |
| Molecular Weight | 175.191 g/mol |
| SMILES | CC(CN1C2=C(C=CC=C2)N=N1)=O |