CID 90417

24220-15-3

Structural Information

Molecular Formula
C20H23N2
SMILES
CC1=CC2=C(C=C1)[N+](=C(C=C2C)C3=CC=C(C=C3)N(C)C)C
InChI
InChI=1S/C20H23N2/c1-14-6-11-19-18(12-14)15(2)13-20(22(19)5)16-7-9-17(10-8-16)21(3)4/h6-13H,1-5H3/q+1
InChIKey
YAIZORIJOGTUIY-UHFFFAOYSA-N
Compound name
N,N-dimethyl-4-(1,4,6-trimethylquinolin-1-ium-2-yl)aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

291.18613 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 292.19341 173.4
[M+Na]+ 314.17535 182.4
[M-H]- 290.17885 181.8
[M+NH4]+ 309.21995 189.3
[M+K]+ 330.14929 172.1
[M+H-H2O]+ 274.18339 166.8
[M+HCOO]- 336.18433 195.1
[M+CH3COO]- 350.19998 207.6
[M+Na-2H]- 312.16080 179.5
[M]+ 291.18558 175.0
[M]- 291.18668 175.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.