| SpectraBase Compound ID | LsPqjfrMScy |
|---|---|
| InChI | InChI=1S/C12H15Cl/c1-3-4-6-10(2)11-7-5-8-12(13)9-11/h3,5,7-10H,1,4,6H2,2H3 |
| InChIKey | XTYINWKLZDOBDS-UHFFFAOYSA-N |
| Mol Weight | 194.7 g/mol |
| Molecular Formula | C12H15Cl |
| Exact Mass | 194.086228 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IfgYN5KDrZE |
|---|---|
| Name | Benzene, 1-chloro-3-(1-methyl-4-pentenyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 194.086228183 u |
| Formula | C12H15Cl |
| InChI | InChI=1S/C12H15Cl/c1-3-4-6-10(2)11-7-5-8-12(13)9-11/h3,5,7-10H,1,4,6H2,2H3 |
| InChIKey | XTYINWKLZDOBDS-UHFFFAOYSA-N |
| Molecular Weight | 194.705 g/mol |
| SMILES | C1(=CC(=CC=C1)Cl)C(CCC=C)C |