| SpectraBase Compound ID | Jw25bOLQdzC |
|---|---|
| InChI | InChI=1S/C14H18/c1-12(2)8-7-9-13(3)14-10-5-4-6-11-14/h4-6,10-11H,1,3,7-9H2,2H3 |
| InChIKey | ILKCXYUULZTOEX-UHFFFAOYSA-N |
| Mol Weight | 186.3 g/mol |
| Molecular Formula | C14H18 |
| Exact Mass | 186.140851 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9S5avOXUcw2 |
|---|---|
| Name | 1,6-Heptadiene, 2-methyl-6-phenyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 186.140850580 u |
| Formula | C14H18 |
| InChI | InChI=1S/C14H18/c1-12(2)8-7-9-13(3)14-10-5-4-6-11-14/h4-6,10-11H,1,3,7-9H2,2H3 |
| InChIKey | ILKCXYUULZTOEX-UHFFFAOYSA-N |
| Molecular Weight | 186.298 g/mol |
| SMILES | C1=CC(C(CCCC(C)=C)=C)=CC=C1 |