| SpectraBase Compound ID | Cn81HfY4BSQ |
|---|---|
| InChI | InChI=1S/C7H14O2.C6H12O2/c1-4-7(9-3)5-6(2)8;1-5(7)4-6(2)8-3/h7H,4-5H2,1-3H3;6H,4H2,1-3H3 |
| InChIKey | GDDSEGKTMKPIOZ-UHFFFAOYSA-N |
| Mol Weight | 246.35 g/mol |
| Molecular Formula | C13H26O4 |
| Exact Mass | 246.183109 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1xmpli4Y2Pj |
|---|---|
| Name | Poly(3-hydroxyvalerate-co-3-hydroxybutyrate) |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 246.183109313 u |
| Formula | C13H26O4 |
| InChI | InChI=1S/C7H14O2.C6H12O2/c1-4-7(9-3)5-6(2)8;1-5(7)4-6(2)8-3/h7H,4-5H2,1-3H3;6H,4H2,1-3H3 |
| InChIKey | GDDSEGKTMKPIOZ-UHFFFAOYSA-N |
| Molecular Weight | 246.347 g/mol |
| Nominal Mass | 246 u |
| SMILES | C(C(OC)C)C(C)=O.C(C(OC)CC)C(C)=O |