| SpectraBase Spectrum ID |
IBZdtxim7I1 |
| Name |
(1-Allyl-6-hydroxy-2-(methylthio)-6-(trifluoromethyl)-1,6-dihydropyrimidin-5-yl)(4-methoxyphenyl)methanone |
| Appearance |
Orange crystals |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H17F3N2O3S |
| InChI |
InChI=1S/C17H17F3N2O3S/c1-4-9-22-15(26-3)21-10-13(16(22,24)17(18,19)20)14(23)11-5-7-12(25-2)8-6-11/h4-8,10,24H,1,9H2,2-3H3 |
| InChIKey |
SQNQIOKQBCAFGO-UHFFFAOYSA-N |
| Instrument Name |
GCMS |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.202000879 |
| Molecular Weight |
386.389 g/mol |
| SMILES |
OC1(C(C(=O)c2ccc(cc2)OC)=CN=C(SC)N1CC=C)C(F)(F)F |
| SPLASH |
splash10-0aor-0496000000-975769e06a113c5766f3 |
| Source of Spectrum |
U1-2020-5533-3w |
| Wiley ID |
1860916 |
