| SpectraBase Compound ID | FceCvrxzcPI |
|---|---|
| InChI | InChI=1S/C16H16O2/c1-12(11-16(17)18)13-7-9-15(10-8-13)14-5-3-2-4-6-14/h2-10,12H,11H2,1H3,(H,17,18) |
| InChIKey | YPLFUSQRFMNDIK-UHFFFAOYSA-N |
| Mol Weight | 240.3 g/mol |
| Molecular Formula | C16H16O2 |
| Exact Mass | 240.11503 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2SjRHdAcvgT |
|---|---|
| Name | 3-(1,1'-Biphenyl-4-yl)butanoic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 240.115029753 u |
| Formula | C16H16O2 |
| InChI | InChI=1S/C16H16O2/c1-12(11-16(17)18)13-7-9-15(10-8-13)14-5-3-2-4-6-14/h2-10,12H,11H2,1H3,(H,17,18) |
| InChIKey | YPLFUSQRFMNDIK-UHFFFAOYSA-N |
| Molecular Weight | 240.302 g/mol |
| SMILES | CC(CC(=O)O)C1=CC=C(C=C1)C1=CC=CC=C1 |