Acid blue 20(12771-92-5) IR1
Product NameAcid blue 20
CAS12771-92-5
Molecular FormulaC30H25N6.Cl
Molecular Weight505.022
InChIInChI=1S/C30H24N6.ClH/c31-23-16-27-29(17-24(23)32)36(22-14-8-3-9-15-22)30-19-26(34-21-12-6-2-7-13-21)25(18-28(30)35-27)33-20-10-4-1-5-11-20;/h1-19H,(H5,31,32,33,34,35);1H
InChIKey ZMWAXVAETNTVAT-UHFFFAOYSA-N
Smiles[N+]1(C2C=CC=CC=2)C2C=C(C(N)=CC=2N=C2C=C(NC3=CC=CC=C3)C(NC3=CC=CC=C3)=CC=12)N.[Cl-]
KBr disc
