| SpectraBase Compound ID | 1HG30RPy7Q6 |
|---|---|
| InChI | InChI=1S/C9H9ClO3/c1-6(10)9(12)13-8-4-2-3-7(11)5-8/h2-6,11H,1H3 |
| InChIKey | NCDWUMCBUSVZHZ-UHFFFAOYSA-N |
| Mol Weight | 200.62 g/mol |
| Molecular Formula | C9H9ClO3 |
| Exact Mass | 200.024022 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 | 1q0PPYFBzUi |
|---|---|
| Name | 1,3-Benzenediol, o-(2-chloropropionyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 200.024021847 u |
| Formula | C9H9ClO3 |
| InChI | InChI=1S/C9H9ClO3/c1-6(10)9(12)13-8-4-2-3-7(11)5-8/h2-6,11H,1H3 |
| InChIKey | NCDWUMCBUSVZHZ-UHFFFAOYSA-N |
| Molecular Weight | 200.621 g/mol |
| SMILES | C1(=CC(=CC=C1)OC(C(C)Cl)=O)O |