| SpectraBase Compound ID | 9Qhq7nfUW4P |
|---|---|
| InChI | InChI=1S/C12H22O4/c1-7(2)15-11(13)9(5)10(6)12(14)16-8(3)4/h7-10H,1-6H3 |
| InChIKey | VKIYYESNNPAVKG-UHFFFAOYSA-N |
| Mol Weight | 230.3 g/mol |
| Molecular Formula | C12H22O4 |
| Exact Mass | 230.151809 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5pa8TSUm5F6 |
|---|---|
| Name | Poly(fumaric acid di-isopropyl ester) |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 230.151809184 u |
| Formula | C12H22O4 |
| InChI | InChI=1S/C12H22O4/c1-7(2)15-11(13)9(5)10(6)12(14)16-8(3)4/h7-10H,1-6H3 |
| InChIKey | VKIYYESNNPAVKG-UHFFFAOYSA-N |
| Molecular Weight | 230.304 g/mol |
| Nominal Mass | 230 u |
| SMILES | CC(C(C)C(=O)OC(C)C)C(OC(C)C)=O |