| SpectraBase Spectrum ID |
AJRxr1bVvVR |
| Name |
Copolyester of 1,4-butanediol with terephthalic and succinic acids |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
394.235538809 u |
| Formula |
C22H34O6 |
| InChI |
InChI=1S/C10H10O2.C6H14O2.C6H10O2/c1-7(11)9-3-5-10(6-4-9)8(2)12;1-7-5-3-4-6-8-2;1-5(7)3-4-6(2)8/h3-6H,1-2H3;3-6H2,1-2H3;3-4H2,1-2H3 |
| InChIKey |
MUDMFRPIVWMZHM-UHFFFAOYSA-N |
| Molecular Weight |
394.508 g/mol |
| Nominal Mass |
394 u |
| SMILES |
C=1C(=CC=C(C1)C(=O)C)C(=O)C.C(OC)CCCOC.C(C(C)=O)CC(C)=O |
| Spectrum/Structure Validation Score (Raman) |
0.958607 |
