| SpectraBase Compound ID | 4HIME4eGEr6 |
|---|---|
| InChI | InChI=1S/C16H14O/c1-12-5-4-6-13(9-12)10-15-11-14-7-2-3-8-16(14)17-15/h2-9,11H,10H2,1H3 |
| InChIKey | RLXNXSHHNBUBSG-UHFFFAOYSA-N |
| Mol Weight | 222.29 g/mol |
| Molecular Formula | C16H14O |
| Exact Mass | 222.104465 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | J6eiYhzQRWB |
|---|---|
| Name | 2-(3-Methylbenzyl)benzofuran |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 222.104465070 u |
| Formula | C16H14O |
| InChI | InChI=1S/C16H14O/c1-12-5-4-6-13(9-12)10-15-11-14-7-2-3-8-16(14)17-15/h2-9,11H,10H2,1H3 |
| InChIKey | RLXNXSHHNBUBSG-UHFFFAOYSA-N |
| Molecular Weight | 222.287 g/mol |
| SMILES | C=1C=C2C=C(OC2=CC1)CC1=CC(=CC=C1)C |