| SpectraBase Compound ID | CZpeaVCgX9o |
|---|---|
| InChI | InChI=1S/C10H11Cl/c1-3-8(2)9-4-6-10(11)7-5-9/h4-7H,2-3H2,1H3 |
| InChIKey | JOKOHULXBGRGNF-UHFFFAOYSA-N |
| Mol Weight | 166.65 g/mol |
| Molecular Formula | C10H11Cl |
| Exact Mass | 166.054928 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | Ez08Td96Wgk |
|---|---|
| Name | Benzene, 1-chloro-4-(1-methylenepropyl)- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 166.054928054 u |
| Formula | C10H11Cl |
| InChI | InChI=1S/C10H11Cl/c1-3-8(2)9-4-6-10(11)7-5-9/h4-7H,2-3H2,1H3 |
| InChIKey | JOKOHULXBGRGNF-UHFFFAOYSA-N |
| Molecular Weight | 166.651 g/mol |
| SMILES | C(C(=C)C1=CC=C(C=C1)Cl)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.882057 |