| SpectraBase Compound ID | LjKTKjHlKEq |
|---|---|
| InChI | InChI=1S/C10H11ClO/c1-12-10-6-2-4-9(8-10)5-3-7-11/h2-6,8H,7H2,1H3/b5-3+ |
| InChIKey | PCROXZYRUXJRIP-HWKANZROSA-N |
| Mol Weight | 182.65 g/mol |
| Molecular Formula | C10H11ClO |
| Exact Mass | 182.049843 g/mol |
Vapor Phase (Gas) Infrared Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 5qKQVPfcgKZ |
|---|---|
| Name | (E)-1-(3'-Chloroprop-1'-enyl)-3-methoxybenzene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 182.049842673 u |
| Formula | C10H11ClO |
| InChI | InChI=1S/C10H11ClO/c1-12-10-6-2-4-9(8-10)5-3-7-11/h2-6,8H,7H2,1H3/b5-3+ |
| InChIKey | PCROXZYRUXJRIP-HWKANZROSA-N |
| Molecular Weight | 182.650 g/mol |
| SMILES | C=1(C=C(C=CC1)OC)\C=C\CCl |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.858064 |