| SpectraBase Spectrum ID |
1tjux0XwTmD |
| Name |
3',4,4''-Trimethoxyterphenyl-2',5'-diyl diacetate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
436.152203106 u |
| Formula |
C25H24O7 |
| InChI |
InChI=1S/C25H24O7/c1-15(26)31-20-13-23(25(32-16(2)27)24(14-20)30-5)21-11-10-19(29-4)12-22(21)17-6-8-18(28-3)9-7-17/h6-14H,1-5H3 |
| InChIKey |
LQAPHFKQOBUNRF-UHFFFAOYSA-N |
| Molecular Weight |
436.460 g/mol |
| SMILES |
C=1(C=2C(C=3C=CC(=CC3)OC)=CC(=CC2)OC)C(=C(OC)C=C(C1)OC(=O)C)OC(=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.907683 |
