| SpectraBase Spectrum ID |
ADqemgUKvnr |
| Name |
(1-Allyl-6-hydroxy-2-(methylthio)-6-(trifluoromethyl)-1,6-dihydropyrimidin-5-yl) (4-nitrophenyl)methanone |
| Appearance |
Yellow solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H14F3N3O4S |
| InChI |
InChI=1S/C16H14F3N3O4S/c1-3-8-21-14(27-2)20-9-12(15(21,24)16(17,18)19)13(23)10-4-6-11(7-5-10)22(25)26/h3-7,9,24H,1,8H2,2H3 |
| InChIKey |
DJONRDJQEDISBO-UHFFFAOYSA-N |
| Instrument Name |
GCMS |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.202000879 |
| Molecular Weight |
401.360 g/mol |
| SMILES |
OC1(N(CC=C)C(=NC=C1C(c1ccc(cc1)[N+]([O-])=O)=O)SC)C(F)(F)F |
| SPLASH |
splash10-001i-0109000000-5970a238c781326649f2 |
| Source of Spectrum |
U1-2020-5534-3ab |
| Wiley ID |
1860892 |
