| SpectraBase Spectrum ID |
CGSqCPuLnPu |
| Name |
3-Methoxy-4,2',5'-trihydroxychalcone, tris(2-methylpropionate) |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
496.209717982 u |
| Formula |
C28H32O8 |
| InChI |
InChI=1S/C28H32O8/c1-16(2)26(30)34-20-10-13-23(35-27(31)17(3)4)21(15-20)22(29)11-8-19-9-12-24(25(14-19)33-7)36-28(32)18(5)6/h8-18H,1-7H3/b11-8+ |
| InChIKey |
YFSXEJJPWHRCBR-DHZHZOJOSA-N |
| Molecular Weight |
496.556 g/mol |
| SMILES |
C1(=CC(=CC=C1OC(C(C)C)=O)OC(C(C)C)=O)C(\C=C\C1=CC=C(C(=C1)OC)OC(C(C)C)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.885976 |
