| SpectraBase Compound ID | 1I5o01cKUib |
|---|---|
| InChI | InChI=1S/C16H16/c1-3-16(2,14-10-6-4-7-11-14)15-12-8-5-9-13-15/h3-13H,1H2,2H3 |
| InChIKey | XBTCBCUOVVISEQ-UHFFFAOYSA-N |
| Mol Weight | 208.3 g/mol |
| Molecular Formula | C16H16 |
| Exact Mass | 208.125201 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BzG41ZhJRMv |
|---|---|
| Name | (1-Methyl-1-phenyl-allyl)benzene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 208.125200515 u |
| Formula | C16H16 |
| InChI | InChI=1S/C16H16/c1-3-16(2,14-10-6-4-7-11-14)15-12-8-5-9-13-15/h3-13H,1H2,2H3 |
| InChIKey | XBTCBCUOVVISEQ-UHFFFAOYSA-N |
| Molecular Weight | 208.304 g/mol |
| SMILES | C(C=C)(C1=CC=CC=C1)(C=1C=CC=CC1)C |