| SpectraBase Spectrum ID |
Ihy35bbGDrF |
| Name |
Fluobutracil |
| Source of Sample |
Sigma-Aldrich Cat. #33659 |
| CAS Registry Number |
134605-64-4 |
| Classification |
Pesticides: Herbicides |
| Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
474.080548491 u |
| Formula |
C20H18ClF3N2O6 |
| InChI |
InChI=1S/C20H18ClF3N2O6/c1-5-8-31-17(29)19(2,3)32-16(28)12-9-11(6-7-13(12)21)26-15(27)10-14(20(22,23)24)25(4)18(26)30/h5-7,9-10H,1,8H2,2-4H3 |
| InChIKey |
JEDYYFXHPAIBGR-UHFFFAOYSA-N |
| Molecular Weight |
474.820 g/mol |
| Number of Peaks |
49 |
| RI1 |
2742 |
| SMILES |
c1(Cl)c(C(=O)OC(C(=O)OCC=C)(C)C)cc(N2C(=O)N(C(C(F)(F)F)=CC2=O)C)cc1 |
| SPLASH |
splash10-001i-1409000000-08f4cf162436cabb61d9 |
| Sample Comments |
RI1: measured on SLB-5ms (Alkanes)
RI2: measured on Equity-1 (Alkanes) |
| Source of Spectrum |
Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy) |
| Synonyms |
Benzoic acid, 2-chloro-5-[3,6-dihydro-3-methyl-2,6-dioxo-4-(trifluoromethyl)-1(2H)-pyrimidinyl]-, 1,1-dimethyl-2-oxo-2-(2-propen-1-yloxy)ethyl ester |
| Wiley ID |
LM_PEST_623 |
