| SpectraBase Compound ID | ADR4ynOR54Q |
|---|---|
| InChI | InChI=1S/C11H14O3/c1-2-14-11(13)10(8-12)9-6-4-3-5-7-9/h3-7,10,12H,2,8H2,1H3 |
| InChIKey | NVWZHTVEPJITPR-UHFFFAOYSA-N |
| Mol Weight | 194.23 g/mol |
| Molecular Formula | C11H14O3 |
| Exact Mass | 194.094294 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | GXD3ogEXG8Z |
|---|---|
| Name | Benzeneacetic acid, .alpha.-(hydroxymethyl)-, ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 194.094294308 u |
| Formula | C11H14O3 |
| InChI | InChI=1S/C11H14O3/c1-2-14-11(13)10(8-12)9-6-4-3-5-7-9/h3-7,10,12H,2,8H2,1H3 |
| InChIKey | NVWZHTVEPJITPR-UHFFFAOYSA-N |
| Molecular Weight | 194.230 g/mol |
| SMILES | C1=CC(C(C(=O)OCC)CO)=CC=C1 |