| SpectraBase Spectrum ID |
GYbDCbsZKyE |
| Name |
4',6'-Dimethoxy-4-dimethylamino-2'-hydroxychalcone, pentafluoropropionate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
473.126163558 u |
| Formula |
C22H20F5NO5 |
| InChI |
InChI=1S/C22H20F5NO5/c1-28(2)14-8-5-13(6-9-14)7-10-16(29)19-17(32-4)11-15(31-3)12-18(19)33-20(30)21(23,24)22(25,26)27/h5-12H,1-4H3/b10-7+ |
| InChIKey |
SLFRHUBXFKZKJR-JXMROGBWSA-N |
| Molecular Weight |
473.396 g/mol |
| SMILES |
C1(=C(C=C(C=C1OC(C(C(F)(F)F)(F)F)=O)OC)OC)C(\C=C\C1=CC=C(C=C1)N(C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.891079 |
