Hofmann’s Violet(8004-86-2) IR1
Product NameHofmann’s Violet
CAS8004-86-2
Molecular FormulaC26H32ClN3
Molecular Weight422.01
InChIInChI=1S/C26H31N3.ClH/c1-5-27-23-13-8-20(9-14-23)26(21-10-15-24(16-11-21)28-6-2)22-12-17-25(29-7-3)19(4)18-22;/h8-18,27-28H,5-7H2,1-4H3;1H/b29-25+;
InChIKey QXSQDMWWOZFKDK-DPWCPDSHSA-N
SmilesC(C1=CC=C(NCC)C=C1)(C1=CC=C(NCC)C=C1)=C1C=CC(=NCC)C(C)=C1.Cl |c:20,24|
