| SpectraBase Compound ID | 9DqDeYoyjar |
|---|---|
| InChI | InChI=1S/C22H18O/c1-4-10-19(11-5-1)16-17-22(21-14-8-3-9-15-21)23-18-20-12-6-2-7-13-20/h1-15,22H,18H2 |
| InChIKey | CCFMWTVUNXJXIX-UHFFFAOYSA-N |
| Mol Weight | 298.38 g/mol |
| Molecular Formula | C22H18O |
| Exact Mass | 298.135765 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | BAqBA1zvXOp |
|---|---|
| Name | Benzyl-(1,3-diphenylprop-2-ynyl)ether |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 298.135765199 u |
| Formula | C22H18O |
| InChI | InChI=1S/C22H18O/c1-4-10-19(11-5-1)16-17-22(21-14-8-3-9-15-21)23-18-20-12-6-2-7-13-20/h1-15,22H,18H2 |
| InChIKey | CCFMWTVUNXJXIX-UHFFFAOYSA-N |
| SMILES | C(#CC1=CC=CC=C1)C(OCC=1C=CC=CC1)C=1C=CC=CC1 |