| SpectraBase Spectrum ID |
6wIyYmPpQvN |
| Name |
Copolyester of 1,4-butanediol and 1,10-decanediol with terephthalic acid |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
482.360739324 u |
| Formula |
C28H50O6 |
| InChI |
InChI=1S/C12H26O2.C10H10O2.C6H14O2/c1-13-11-9-7-5-3-4-6-8-10-12-14-2;1-7(11)9-3-5-10(6-4-9)8(2)12;1-7-5-3-4-6-8-2/h3-12H2,1-2H3;3-6H,1-2H3;3-6H2,1-2H3 |
| InChIKey |
BQEITLRAZBQOJJ-UHFFFAOYSA-N |
| Molecular Weight |
482.702 g/mol |
| Nominal Mass |
482 u |
| SMILES |
C=1C(=CC=C(C1)C(=O)C)C(=O)C.C(OC)CCCOC.C(OC)CCCCCCCCCOC |
| Spectrum/Structure Validation Score (Raman) |
0.993295 |
