| SpectraBase Spectrum ID |
5x0zeFR0E5W |
| Name |
(1-Allyl-6-hydroxy-2-(methylthio)-6-(trifluoromethyl)-1,6-dihydropyrimidin-5-yl) (4-fluorophenyl)methanone |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H14F4N2O2S |
| InChI |
InChI=1S/C16H14F4N2O2S/c1-3-8-22-14(25-2)21-9-12(15(22,24)16(18,19)20)13(23)10-4-6-11(17)7-5-10/h3-7,9,24H,1,8H2,2H3 |
| InChIKey |
ITKPEJZJFKLHIK-UHFFFAOYSA-N |
| Instrument Name |
GCMS |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.202000879 |
| Molecular Weight |
374.354 g/mol |
| SMILES |
OC1(N(CC=C)C(=NC=C1C(c1ccc(F)cc1)=O)SC)C(F)(F)F |
| SPLASH |
splash10-0a4i-1339000000-2a89da678c0f31cd339d |
| Source of Spectrum |
U1-2020-5534-3z |
| Wiley ID |
1860919 |
