| SpectraBase Compound ID | 9r4OeEp2xsR |
|---|---|
| InChI | InChI=1S/C21H22O5/c1-13(2)20(23)25-17-11-7-5-9-15(17)19(22)16-10-6-8-12-18(16)26-21(24)14(3)4/h5-14H,1-4H3 |
| InChIKey | AMBPVVDGDZNXGX-UHFFFAOYSA-N |
| Mol Weight | 354.4 g/mol |
| Molecular Formula | C21H22O5 |
| Exact Mass | 354.146724 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Hts1Tx71ujF |
|---|---|
| Name | 2,2'-Dihydroxybenzophenone, bis(2-methylpropionate) |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 354.146723803 u |
| Formula | C21H22O5 |
| InChI | InChI=1S/C21H22O5/c1-13(2)20(23)25-17-11-7-5-9-15(17)19(22)16-10-6-8-12-18(16)26-21(24)14(3)4/h5-14H,1-4H3 |
| InChIKey | AMBPVVDGDZNXGX-UHFFFAOYSA-N |
| Molecular Weight | 354.402 g/mol |
| SMILES | C1(OC(C(C)C)=O)=C(C=CC=C1)C(=O)C1=C(C=CC=C1)OC(C(C)C)=O |