| SpectraBase Compound ID | KSagi8NoAGT |
|---|---|
| InChI | InChI=1S/C14H12N2O/c1-10(17)8-16-9-15-12-6-2-4-11-5-3-7-13(16)14(11)12/h2-7,9H,8H2,1H3 |
| InChIKey | PKCBGFUALNOFJM-UHFFFAOYSA-N |
| Mol Weight | 224.26 g/mol |
| Molecular Formula | C14H12N2O |
| Exact Mass | 224.094963 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HXf6deSqCBH |
|---|---|
| Name | 1-(1-Perimidinyl)-2-propanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 224.094963013 u |
| Formula | C14H12N2O |
| InChI | InChI=1S/C14H12N2O/c1-10(17)8-16-9-15-12-6-2-4-11-5-3-7-13(16)14(11)12/h2-7,9H,8H2,1H3 |
| InChIKey | PKCBGFUALNOFJM-UHFFFAOYSA-N |
| Molecular Weight | 224.263 g/mol |
| SMILES | C=1N(C2=C3C(N1)=CC=CC3=CC=C2)CC(=O)C |