SpectraBase Spectrum ID |
DTvB82DtT5c |
Name |
3-(tert-Butylamino)-5-(dimethylamino)-2-(methylthio)-2-phenyl-2H-pyrrolium Iodide |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C17H26IN3S |
InChI |
InChI=1S/C17H25N3S.HI/c1-16(2,3)18-14-12-15(20(4)5)19-17(14,21-6)13-10-8-7-9-11-13;/h7-12,18H,1-6H3;1H |
InChIKey |
FTQSGKOVCOBODR-UHFFFAOYSA-N |
Literature Reference DOI |
10.1002_1098-1071(2000)11_5_370 |
Molecular Weight |
431.380 g/mol |
SMILES |
N(C(C)(C)C)C1=CC(=[NH+]C1(c1ccccc1)SC)N(C)C.[I-] |
SPLASH |
splash10-0a4j-3390000000-a13b5c99277ce1ef07fc |
Source of Spectrum |
HAC-11-376-7a |
Synonyms |
3-(tert-butylamino)-5-(dimethylamino)-2-(methylthio)-2-phenyl-2H-pyrrol-1-ium iodide |
Wiley ID |
1775794 |