SpectraBase Spectrum ID |
K07Qeh8Urb4 |
Name |
Poly(1,3-propanediol adipate-co-isophthalate) |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
408.251188873 u |
Formula |
C23H36O6 |
InChI |
InChI=1S/C10H10O2.C8H14O2.C5H12O2/c1-7(11)9-4-3-5-10(6-9)8(2)12;1-7(9)5-3-4-6-8(2)10;1-6-4-3-5-7-2/h3-6H,1-2H3;3-6H2,1-2H3;3-5H2,1-2H3 |
InChIKey |
ZPBNAYITJTWOGR-UHFFFAOYSA-N |
Molecular Weight |
408.535 g/mol |
Nominal Mass |
408 u |
SMILES |
C(C(=O)C)CCCC(=O)C.C=1C=C(C=C(C1)C(=O)C)C(=O)C.C(OC)CCOC |