| SpectraBase Compound ID | CQdX7N4c43Z |
|---|---|
| InChI | InChI=1S/C14H12O2/c15-14(16)13-8-6-12(7-9-13)10-11-4-2-1-3-5-11/h1-9H,10H2,(H,15,16) |
| InChIKey | FPHVRPCVNPHPBH-UHFFFAOYSA-N |
| Mol Weight | 212.25 g/mol |
| Molecular Formula | C14H12O2 |
| Exact Mass | 212.08373 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1IZViXCHm9E |
|---|---|
| Name | Benzoic acid, 4-(phenylmethyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 212.083729624 u |
| Formula | C14H12O2 |
| InChI | InChI=1S/C14H12O2/c15-14(16)13-8-6-12(7-9-13)10-11-4-2-1-3-5-11/h1-9H,10H2,(H,15,16) |
| InChIKey | FPHVRPCVNPHPBH-UHFFFAOYSA-N |
| Molecular Weight | 212.248 g/mol |
| SMILES | C1=C(C=CC(=C1)C(O)=O)CC1=CC=CC=C1 |