| SpectraBase Compound ID | 1bgL65e72ml |
|---|---|
| InChI | InChI=1S/C21H24O4/c1-3-21(2,20(23)25-16-18-12-8-5-9-13-18)14-19(22)24-15-17-10-6-4-7-11-17/h4-13H,3,14-16H2,1-2H3 |
| InChIKey | NZSILBAZCJEBLU-UHFFFAOYSA-N |
| Mol Weight | 340.42 g/mol |
| Molecular Formula | C21H24O4 |
| Exact Mass | 340.167459 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6RUVYwttRET |
|---|---|
| Name | Poly(dibenzyl itaconate) |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 340.167459249 u |
| Formula | C21H24O4 |
| InChI | InChI=1S/C21H24O4/c1-3-21(2,20(23)25-16-18-12-8-5-9-13-18)14-19(22)24-15-17-10-6-4-7-11-17/h4-13H,3,14-16H2,1-2H3 |
| InChIKey | NZSILBAZCJEBLU-UHFFFAOYSA-N |
| Molecular Weight | 340.419 g/mol |
| Nominal Mass | 340 u |
| SMILES | C(OC(C(C)(CC)CC(OCC1=CC=CC=C1)=O)=O)C=1C=CC=CC1 |