![[4-(1,2-Dimethylallyl)phenyl]-phenyl-methanone](/api/spectrum/pBxtUdIhjd/structure.png?h=300&w=458 "[4-(1,2-Dimethylallyl)phenyl]-phenyl-methanone")
| SpectraBase Compound ID | ANU6N3HdLhv |
|---|---|
| InChI | InChI=1S/C18H18O/c1-13(2)14(3)15-9-11-17(12-10-15)18(19)16-7-5-4-6-8-16/h4-12,14H,1H2,2-3H3 |
| InChIKey | TZSYQMUFKVORBT-UHFFFAOYSA-N |
| Mol Weight | 250.34 g/mol |
| Molecular Formula | C18H18O |
| Exact Mass | 250.135765 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | pBxtUdIhjd |
|---|---|
| Name | [4-(1,2-Dimethylallyl)phenyl]-phenyl-methanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 250.135765199 u |
| Formula | C18H18O |
| InChI | InChI=1S/C18H18O/c1-13(2)14(3)15-9-11-17(12-10-15)18(19)16-7-5-4-6-8-16/h4-12,14H,1H2,2-3H3 |
| InChIKey | TZSYQMUFKVORBT-UHFFFAOYSA-N |
| Molecular Weight | 250.341 g/mol |
| SMILES | C=C(C(C)C=1C=CC(=CC1)C(C=1C=CC=CC1)=O)C |