![4-[1,1'-Biphenyl]-4-yl-2-methyl-3-butyn-2-ol](/api/spectrum/3P64nbtWNg1/structure.png?h=300&w=458 "4-[1,1'-Biphenyl]-4-yl-2-methyl-3-butyn-2-ol")
| SpectraBase Compound ID | KXcCpoUXeG0 |
|---|---|
| InChI | InChI=1S/C17H16O/c1-17(2,18)13-12-14-8-10-16(11-9-14)15-6-4-3-5-7-15/h3-11,18H,1-2H3 |
| InChIKey | AGQJZAHQDBUXDB-UHFFFAOYSA-N |
| Mol Weight | 236.31 g/mol |
| Molecular Formula | C17H16O |
| Exact Mass | 236.120115 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
Subscribe to view the full spectrum.
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 3P64nbtWNg1 |
|---|---|
| Name | 4-[1,1'-Biphenyl]-4-yl-2-methyl-3-butyn-2-ol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 236.120115134 u |
| Formula | C17H16O |
| InChI | InChI=1S/C17H16O/c1-17(2,18)13-12-14-8-10-16(11-9-14)15-6-4-3-5-7-15/h3-11,18H,1-2H3 |
| InChIKey | AGQJZAHQDBUXDB-UHFFFAOYSA-N |
| Molecular Weight | 236.314 g/mol |
| SMILES | C(O)(C)(C)C#CC1=CC=C(C=C1)C1=CC=CC=C1 |