| SpectraBase Compound ID | Cb46iyfG39K |
|---|---|
| InChI | InChI=1S/C10H7Cl2NO2/c1-2-5-15-10(14)13-9-4-3-7(11)6-8(9)12/h1,3-4,6H,5H2,(H,13,14) |
| InChIKey | KWHPHVVVXTYHLS-UHFFFAOYSA-N |
| Mol Weight | 244.08 g/mol |
| Molecular Formula | C10H7Cl2NO2 |
| Exact Mass | 242.985384 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5wFG5R3MnDd |
|---|---|
| Name | Carbamic acid, N-(2,4-dichlorophenyl)-, 2-propynyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 242.985383867 u |
| Formula | C10H7Cl2NO2 |
| InChI | InChI=1S/C10H7Cl2NO2/c1-2-5-15-10(14)13-9-4-3-7(11)6-8(9)12/h1,3-4,6H,5H2,(H,13,14) |
| InChIKey | KWHPHVVVXTYHLS-UHFFFAOYSA-N |
| Molecular Weight | 244.077 g/mol |
| SMILES | C(NC1=C(C=C(C=C1)Cl)Cl)(=O)OCC#C |