| SpectraBase Compound ID | 6H74A0WiHaD |
|---|---|
| InChI | InChI=1S/C16H22O5/c1-3-20-14(17)16(19,15(18)21-4-2)12-8-11-13-9-6-5-7-10-13/h5-7,9-10,19H,3-4,8,11-12H2,1-2H3 |
| InChIKey | UDQUUXXXZJSWQI-UHFFFAOYSA-N |
| Mol Weight | 294.35 g/mol |
| Molecular Formula | C16H22O5 |
| Exact Mass | 294.146724 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6CF2cnCPUg9 |
|---|---|
| Name | Diethyl 1-hydroxy-4-phenylbutane-1,1-dicarboxylate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 294.146723803 u |
| Formula | C16H22O5 |
| InChI | InChI=1S/C16H22O5/c1-3-20-14(17)16(19,15(18)21-4-2)12-8-11-13-9-6-5-7-10-13/h5-7,9-10,19H,3-4,8,11-12H2,1-2H3 |
| InChIKey | UDQUUXXXZJSWQI-UHFFFAOYSA-N |
| Molecular Weight | 294.347 g/mol |
| SMILES | C(CCCC=1C=CC=CC1)(C(=O)OCC)(C(=O)OCC)O |