| SpectraBase Spectrum ID |
EL4bESclNjj |
| Name |
1-Methyl N1-(2,4,6-trifluorophenyl)-3,5-dinitro-1-benzenecarboximidothioate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H8F3N3O4S |
| InChI |
InChI=1S/C14H8F3N3O4S/c1-25-14(18-13-11(16)4-8(15)5-12(13)17)7-2-9(19(21)22)6-10(3-7)20(23)24/h2-6H,1H3/b18-14- |
| InChIKey |
HFCAOYIOAJTYFU-JXAWBTAJSA-N |
| Molecular Weight |
371.290 g/mol |
| SMILES |
c1(\N=C\(c2cc(N(=O)=O)cc(N(=O)=O)c2)SC)c(cc(cc1F)F)F |
| SPLASH |
splash10-004i-9001000000-3f90f06cf932ff247771 |
| Source of Spectrum |
EJ-42-39-31 |
| Wiley ID |
1676510 |
