| SpectraBase Compound ID | AtcFEszXMTp |
|---|---|
| InChI | InChI=1S/C9H11ClO3/c1-5(11)6-3-9(13-2)8(12)4-7(6)10/h3-5,11-12H,1-2H3 |
| InChIKey | RBFHSILGNPHHQI-UHFFFAOYSA-N |
| Mol Weight | 202.64 g/mol |
| Molecular Formula | C9H11ClO3 |
| Exact Mass | 202.039672 g/mol |
Raman Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 3D2DsXuYVbQ |
|---|---|
| Name | 6-Chloro-o-methylvanillyl alcohol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 202.039671911 u |
| Formula | C9H11ClO3 |
| InChI | InChI=1S/C9H11ClO3/c1-5(11)6-3-9(13-2)8(12)4-7(6)10/h3-5,11-12H,1-2H3 |
| InChIKey | RBFHSILGNPHHQI-UHFFFAOYSA-N |
| Molecular Weight | 202.637 g/mol |
| SMILES | OC1=C(C=C(C(C)O)C(=C1)Cl)OC |
| Spectrum/Structure Validation Score (Raman) | 0.912529 |