| SpectraBase Compound ID | D5h7FPYVMdl |
|---|---|
| InChI | InChI=1S/C12H14N2O2/c1-2-5-11-13-9-6-3-4-7-10(9)14(11)8-12(15)16/h3-4,6-7H,2,5,8H2,1H3,(H,15,16) |
| InChIKey | SQKBAAWXVRUDNZ-UHFFFAOYSA-N |
| Mol Weight | 218.26 g/mol |
| Molecular Formula | C12H14N2O2 |
| Exact Mass | 218.105528 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | F2H8jg97YS7 |
|---|---|
| Name | Acetic acid, 2-(2-propyl-1-benzimidazolyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 218.105527697 u |
| Formula | C12H14N2O2 |
| InChI | InChI=1S/C12H14N2O2/c1-2-5-11-13-9-6-3-4-7-10(9)14(11)8-12(15)16/h3-4,6-7H,2,5,8H2,1H3,(H,15,16) |
| InChIKey | SQKBAAWXVRUDNZ-UHFFFAOYSA-N |
| Molecular Weight | 218.256 g/mol |
| SMILES | CCCC1=NC2=CC=CC=C2N1CC(=O)O |