SpectraBase Spectrum ID |
5m72OLhIif4 |
Name |
Copolyester of bisphenol A with isophthalic and terephthalic acids |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
566.266838938 u |
Formula |
C36H38O6 |
InChI |
InChI=1S/C17H20O2.C10H10O2.C9H8O2/c1-17(2,13-5-9-15(18-3)10-6-13)14-7-11-16(19-4)12-8-14;1-7(11)9-3-5-10(6-4-9)8(2)12;1-7(11)9-4-2-3-8(5-9)6-10/h5-12H,1-4H3;3-6H,1-2H3;2-6H,1H3 |
InChIKey |
CYTBENIPWZKKEG-UHFFFAOYSA-N |
Molecular Weight |
566.694 g/mol |
Nominal Mass |
566 u |
SMILES |
C1=CC(=CC=C1OC)C(C)(C)C1=CC=C(C=C1)OC.C=1C=CC(=CC1C(=O)C)C=O.C1=CC(=CC=C1C(C)=O)C(=O)C |