| SpectraBase Compound ID | EGgBggl39rS |
|---|---|
| InChI | InChI=1S/C9H7Cl/c1-2-3-8-4-6-9(10)7-5-8/h4-7H,1H3 |
| InChIKey | CLGJQIMOOUFULP-UHFFFAOYSA-N |
| Mol Weight | 150.61 g/mol |
| Molecular Formula | C9H7Cl |
| Exact Mass | 150.023628 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 | 10llpciTm9J |
|---|---|
| Name | Benzene, 1-chloro-4-(1-propynyl)- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 150.023627925 u |
| Formula | C9H7Cl |
| InChI | InChI=1S/C9H7Cl/c1-2-3-8-4-6-9(10)7-5-8/h4-7H,1H3 |
| InChIKey | CLGJQIMOOUFULP-UHFFFAOYSA-N |
| Molecular Weight | 150.608 g/mol |
| SMILES | C(#CC1=CC=C(C=C1)Cl)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.848153 |