SpectraBase Spectrum ID |
6vF9OPZn0Tc |
Name |
2-Hydroxy-2-methyl-2-(1',3',4',5',6',7'-hexahydro-1',3'-diazepin-2'-ylium)-1-[(p-chlorophenyl)imino]-thiolate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C14H18ClN3OS |
InChI |
InChI=1S/C14H18ClN3OS/c1-14(19,12-16-8-2-3-9-17-12)13(20)18-11-6-4-10(15)5-7-11/h4-7,19H,2-3,8-9H2,1H3,(H,16,17)(H,18,20) |
InChIKey |
JBBKKLCYHKDAEE-UHFFFAOYSA-N |
Molecular Weight |
311.831 g/mol |
SMILES |
N1CCCCN=[C+]1C([C-](=Nc1ccc(cc1)Cl)S)(O)C |
SPLASH |
splash10-0006-1900000000-3e451ef3e024e0dd0e9d |
Source of Spectrum |
D1-2002-1833-3 |
Wiley ID |
1548153 |