| SpectraBase Spectrum ID |
2EYY6YnjeOz |
| Name |
(4-methylbenzoyl)(5,6,7,8-tetrahydro-4H-cyclohepta[c]isothiazol-1-ium-1-yl)amide |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H18N2OS |
| InChI |
InChI=1S/C16H18N2OS/c1-12-7-9-13(10-8-12)16(19)17-18-15-6-4-2-3-5-14(15)11-20-18/h7-11H,2-6H2,1H3 |
| InChIKey |
KKYJXEVZLRTOCT-UHFFFAOYSA-N |
| Literature Reference DOI |
10.1002/prac.19943360204 |
| Molecular Weight |
286.393 g/mol |
| SMILES |
c1s[n+](c2c1CCCCC2)[N-]C(c1ccc(cc1)C)=O |
| SPLASH |
splash10-014i-2920000000-e2d34430e51021ff9951 |
| Source of Spectrum |
JF-336-120-11b |
| Wiley ID |
1789866 |
![(4-methylbenzoyl)(5,6,7,8-tetrahydro-4H-cyclohepta[c]isothiazol-1-ium-1-yl)amide](/api/spectrum/2EYY6YnjeOz/structure.png?h=300&w=458 "(4-methylbenzoyl)(5,6,7,8-tetrahydro-4H-cyclohepta[c]isothiazol-1-ium-1-yl)amide")
