SpectraBase Spectrum ID |
J8lnUisyqv7 |
Name |
1-[N-Benzyl-N-[3-bromo-5-(1-benzothiophen-3-yl)pyrazin-2-yl]amino]pyridinium bromide |
Appearance |
Beige solid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C24H18Br2N4S |
InChI |
InChI=1S/C24H18BrN4S.BrH/c25-23-24(26-15-21(27-23)20-17-30-22-12-6-5-11-19(20)22)29(28-13-7-2-8-14-28)16-18-9-3-1-4-10-18;/h1-15,17H,16H2;1H/q+1;/p-1 |
InChIKey |
CDQHHZZWJKCEII-UHFFFAOYSA-M |
Instrument Name |
Hewlett-Packard 5988A |
Ionization Type |
EI |
Literature Reference DOI |
10.3998/ark.5550190.p008.720 |
Molecular Weight |
554.304 g/mol |
Reported Formula |
C19H15(79)BrN3S |
SMILES |
[Br-].c1cc2c(cc1)c(cs2)-c1cnc(c(n1)Br)N(Cc1ccccc1)[n+]1ccccc1 |
SPLASH |
splash10-0006-1958000000-d164da1b10970e329c8b |
Source of Spectrum |
ARK-2014-330-9d |
Wiley ID |
1845647 |