| SpectraBase Spectrum ID |
9uoAF8plMqs |
| Name |
N-(2,4,6-Trifluorophenyl)-3,5-dinitrobenzothioamide |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H6F3N3O4S |
| InChI |
InChI=1S/C13H6F3N3O4S/c14-7-3-10(15)12(11(16)4-7)17-13(24)6-1-8(18(20)21)5-9(2-6)19(22)23/h1-5H,(H,17,24) |
| InChIKey |
KHMHWCOMSCQAAI-UHFFFAOYSA-N |
| Molecular Weight |
357.263 g/mol |
| SMILES |
N(c1c(cc(cc1F)F)F)C(c1cc(N(=O)=O)cc(N(=O)=O)c1)=S |
| SPLASH |
splash10-014i-9003000000-273658b2ad7d0e784393 |
| Source of Spectrum |
EJ-42-38-18 |
| Synonyms |
3,5-dinitro-N-(2,4,6-trifluorophenyl)benzenecarbothioamide
3,5-dinitro-N-[2,4,6-tris(fluoranyl)phenyl]benzenecarbothioamide |
| Wiley ID |
1676522 |
