| SpectraBase Compound ID | JdSSPSsG5ED |
|---|---|
| InChI | InChI=1S/C16H22O4/c1-5-16(3,10-19-4)11-20-15(18)14-8-6-7-13(9-14)12(2)17/h6-9H,5,10-11H2,1-4H3 |
| InChIKey | VHPVLURRWGIGPB-UHFFFAOYSA-N |
| Mol Weight | 278.35 g/mol |
| Molecular Formula | C16H22O4 |
| Exact Mass | 278.151809 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DYib843w7F5 |
|---|---|
| Name | Poly(2-ethyl-2-methyl-1,3-propanediol isophthalate) |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 278.151809184 u |
| Formula | C16H22O4 |
| InChI | InChI=1S/C16H22O4/c1-5-16(3,10-19-4)11-20-15(18)14-8-6-7-13(9-14)12(2)17/h6-9H,5,10-11H2,1-4H3 |
| InChIKey | VHPVLURRWGIGPB-UHFFFAOYSA-N |
| Molecular Weight | 278.348 g/mol |
| Nominal Mass | 278 u |
| SMILES | C(OC(C1=CC=CC(=C1)C(=O)C)=O)C(COC)(C)CC |