Basic Violet 2(3248-91-7) IR1
Product NameBasic Violet 2
CAS3248-91-7
Molecular FormulaC22H24ClN3
Molecular Weight365.91
InChIInChI=1S/C22H23N3.ClH/c1-13-10-16(4-7-19(13)23)22(17-5-8-20(24)14(2)11-17)18-6-9-21(25)15(3)12-18;/h4-12,23H,24-25H2,1-3H3;1H
InChIKey IPSIPYMEZZPCPY-UHFFFAOYSA-N
SmilesC(=C1C=CC(=N)C(C)=C1)(C1C=CC(N)=C(C)C=1)C1C=CC(N)=C(C)C=1.Cl
parameter in DMSO-d6
-
1H NMR 300 MHz C22 H24 Cl N3 0.049 g : 0.5 ml DMSO-d6 new fuchsin 
Parameter ppm Hz
D(A) 7.012 D(B) 6.979 D(C) 6.854 J(A,B) 2.0 J(A,C) 8.5 J(B,C) 0. D(D) 2.101
Hz ppm Int.2109.27 7.031 65 2107.36 7.025 84 2100.89 7.003 79 2098.93 6.996 134 2094.61 6.982 212 2092.65 6.975 141 2060.05 6.867 192 2051.67 6.839 137 630.29 2.101 1000
in DMSO-d6
KBr disc
nujol mull
