| SpectraBase Spectrum ID |
6WXnSKCicEP |
| Name |
(1-Ethyl-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 |
C15H14F3N3O4S |
| InChI |
InChI=1S/C15H14F3N3O4S/c1-3-20-13(26-2)19-8-11(14(20,23)15(16,17)18)12(22)9-4-6-10(7-5-9)21(24)25/h4-8,23H,3H2,1-2H3 |
| InChIKey |
CRCMMCDDKYQUGH-UHFFFAOYSA-N |
| Instrument Name |
GCMS |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.202000879 |
| Molecular Weight |
389.349 g/mol |
| SMILES |
OC1(C(C(=O)c2ccc(cc2)[N+]([O-])=O)=CN=C(SC)N1CC)C(F)(F)F |
| SPLASH |
splash10-00di-0209000000-fc22d56b31a292fbd742 |
| Source of Spectrum |
U1-2020-5533-3r |
| Wiley ID |
1860911 |
