| SpectraBase Compound ID | KYrpiJtbNET |
|---|---|
| InChI | InChI=1S/C9H6Cl2/c1-2-3-7-4-5-8(10)9(11)6-7/h3-6H,1H2 |
| InChIKey | NGJMCRMURUXOLW-UHFFFAOYSA-N |
| Mol Weight | 185.05 g/mol |
| Molecular Formula | C9H6Cl2 |
| Exact Mass | 183.984656 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 | 2tQZtF9TEoz |
|---|---|
| Name | 1,2-Dichloro-4-(propa-1,2-dien-1-yl)benzene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 183.984655593 u |
| Formula | C9H6Cl2 |
| InChI | InChI=1S/C9H6Cl2/c1-2-3-7-4-5-8(10)9(11)6-7/h3-6H,1H2 |
| InChIKey | NGJMCRMURUXOLW-UHFFFAOYSA-N |
| Molecular Weight | 185.053 g/mol |
| SMILES | C=1(C=C=C)C=C(C(=CC1)Cl)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.901411 |