| SpectraBase Compound ID | GcRiRyAnBDn |
|---|---|
| InChI | InChI=1S/C10H15Cl/c1-10(2,3)8-6-4-5-7-9-11/h4-9H,1-3H3/b5-4+,8-6+,9-7+ |
| InChIKey | NOITVXDIERLTAK-WUJFNTSISA-N |
| Mol Weight | 170.68 g/mol |
| Molecular Formula | C10H15Cl |
| Exact Mass | 170.086228 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ANVVM1nntzX |
|---|---|
| Name | (1E,3E,5E)-1-Chloranyl-7,7-dimethyl-octa-1,3,5-triene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 170.086228183 u |
| Formula | C10H15Cl |
| InChI | InChI=1S/C10H15Cl/c1-10(2,3)8-6-4-5-7-9-11/h4-9H,1-3H3/b5-4+,8-6+,9-7+ |
| InChIKey | NOITVXDIERLTAK-WUJFNTSISA-N |
| Molecular Weight | 170.683 g/mol |
| SMILES | C(\C=C\C=C\C=C\Cl)(C)(C)C |