![2-[Hydroxy(phenyl)methyl]-2-propenoic acid tert-butyl ester](/api/spectrum/A8hSRZrPHdk/structure.png?h=300&w=458 "2-[Hydroxy(phenyl)methyl]-2-propenoic acid tert-butyl ester")
| SpectraBase Compound ID | IjXjUI9bmEp |
|---|---|
| InChI | InChI=1S/C14H18O3/c1-10(13(16)17-14(2,3)4)12(15)11-8-6-5-7-9-11/h5-9,12,15H,1H2,2-4H3 |
| InChIKey | QDTMXXIXRPMTJI-UHFFFAOYSA-N |
| Mol Weight | 234.29 g/mol |
| Molecular Formula | C14H18O3 |
| Exact Mass | 234.125594 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | A8hSRZrPHdk |
|---|---|
| Name | 2-[Hydroxy(phenyl)methyl]-2-propenoic acid tert-butyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 234.125594437 u |
| Formula | C14H18O3 |
| InChI | InChI=1S/C14H18O3/c1-10(13(16)17-14(2,3)4)12(15)11-8-6-5-7-9-11/h5-9,12,15H,1H2,2-4H3 |
| InChIKey | QDTMXXIXRPMTJI-UHFFFAOYSA-N |
| Molecular Weight | 234.295 g/mol |
| SMILES | C(C(OC(C)(C)C)=O)(C(C=1C=CC=CC1)O)=C |