| SpectraBase Compound ID | GCJNbR7JrLh |
|---|---|
| InChI | InChI=1S/C16H22O4/c1-13(17)14-7-9-15(10-8-14)16(18)20-12-6-4-3-5-11-19-2/h7-10H,3-6,11-12H2,1-2H3 |
| InChIKey | HVTCKYUBSQYEPU-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 | Hk8s0a6kWmw |
|---|---|
| Name | Poly(hexamethylene terephthalate) |
| 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/c1-13(17)14-7-9-15(10-8-14)16(18)20-12-6-4-3-5-11-19-2/h7-10H,3-6,11-12H2,1-2H3 |
| InChIKey | HVTCKYUBSQYEPU-UHFFFAOYSA-N |
| Molecular Weight | 278.348 g/mol |
| Nominal Mass | 278 u |
| SMILES | C(CCCCCOC)OC(C=1C=CC(=CC1)C(=O)C)=O |