![Benzoic acid, 4-[(2-methylphenyl)methoxy]-](/api/spectrum/7eQj2r0FEsQ/structure.png?h=300&w=458 "Benzoic acid, 4-[(2-methylphenyl)methoxy]-")
| SpectraBase Compound ID | 2GL6QYwZXPM |
|---|---|
| InChI | InChI=1S/C15H14O3/c1-11-4-2-3-5-13(11)10-18-14-8-6-12(7-9-14)15(16)17/h2-9H,10H2,1H3,(H,16,17) |
| InChIKey | YBAKJGNELKZYKS-UHFFFAOYSA-N |
| Mol Weight | 242.27 g/mol |
| Molecular Formula | C15H14O3 |
| Exact Mass | 242.094294 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7eQj2r0FEsQ |
|---|---|
| Name | Benzoic acid, 4-[(2-methylphenyl)methoxy]- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 242.094294308 u |
| Formula | C15H14O3 |
| InChI | InChI=1S/C15H14O3/c1-11-4-2-3-5-13(11)10-18-14-8-6-12(7-9-14)15(16)17/h2-9H,10H2,1H3,(H,16,17) |
| InChIKey | YBAKJGNELKZYKS-UHFFFAOYSA-N |
| Molecular Weight | 242.274 g/mol |
| SMILES | OC(C=1C=CC(OCC2=C(C)C=CC=C2)=CC1)=O |