| SpectraBase Spectrum ID |
LvggRNuW2Cn |
| Name |
2',3',4'-Trihydroxychalcone, tris(2-methylpropionate) |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
466.199153299 u |
| Formula |
C27H30O7 |
| InChI |
InChI=1S/C27H30O7/c1-16(2)25(29)32-22-15-13-20(21(28)14-12-19-10-8-7-9-11-19)23(33-26(30)17(3)4)24(22)34-27(31)18(5)6/h7-18H,1-6H3/b14-12+ |
| InChIKey |
YCZRDWFMDDQENB-WYMLVPIESA-N |
| Molecular Weight |
466.530 g/mol |
| SMILES |
C1(=CC=C(C(=C1OC(C(C)C)=O)OC(C(C)C)=O)OC(C(C)C)=O)C(\C=C\C1=CC=CC=C1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.951999 |
