![5-Chloro-1,3-dimethyl-1H-benzo[d]imidazol-2(3H)-one](/api/spectrum/4FDtb9ztdSj/structure.png?h=300&w=458 "5-Chloro-1,3-dimethyl-1H-benzo[d]imidazol-2(3H)-one")
| SpectraBase Compound ID | 5NmSJKheum7 |
|---|---|
| InChI | InChI=1S/C9H9ClN2O/c1-11-7-4-3-6(10)5-8(7)12(2)9(11)13/h3-5H,1-2H3 |
| InChIKey | FCYDPVMOBHGVPW-UHFFFAOYSA-N |
| Mol Weight | 196.64 g/mol |
| Molecular Formula | C9H9ClN2O |
| Exact Mass | 196.040341 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4FDtb9ztdSj |
|---|---|
| Name | 5-Chloro-1,3-dimethyl-1H-benzo[D]imidazol-2(3H)-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 196.040340617 u |
| Formula | C9H9ClN2O |
| InChI | InChI=1S/C9H9ClN2O/c1-11-7-4-3-6(10)5-8(7)12(2)9(11)13/h3-5H,1-2H3 |
| InChIKey | FCYDPVMOBHGVPW-UHFFFAOYSA-N |
| Molecular Weight | 196.637 g/mol |
| SMILES | C1=C(C=C2N(C(N(C2=C1)C)=O)C)Cl |