| SpectraBase Spectrum ID |
K0DjH5TRiWo |
| Name |
1,3,5,2,4-Trithia(3-SIV)diazepine-6-carboxylic acid, 7-(trifluoromethyl)-, ethyl ester |
| CAS Registry Number |
110654-26-7 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C6H5F3N2O2S3 |
| InChI |
InChI=1S/C6H5F3N2O2S3/c1-2-13-5(12)3-4(6(7,8)9)15-11-16-10-14-3/h2H2,1H3 |
| InChIKey |
BVDKZTUWLAVWCR-UHFFFAOYSA-N |
| Molecular Weight |
290.293 g/mol |
| SMILES |
C=1(C(=S=NSN=S1)C(=O)OCC)C(F)(F)F |
| SPLASH |
splash10-004m-9360000000-db15f0bea6b7d49f629b |
| Source of Spectrum |
KC-1987-1589-11 |
| Synonyms |
Ethyl 7-(trifluoromethyl)-1,3,5,2,4-trithiadiazepine-6-carboxylate |
| Wiley ID |
1292945 |
