CID 212936

25413-35-8

Structural Information

Molecular Formula
C18H19N2
SMILES
C[N+]1=C(C=CC2=CC=CC=C21)C3=CC=C(C=C3)N(C)C
InChI
InChI=1S/C18H19N2/c1-19(2)16-11-8-15(9-12-16)18-13-10-14-6-4-5-7-17(14)20(18)3/h4-13H,1-3H3/q+1
InChIKey
WRXIHJQKDWSVOH-UHFFFAOYSA-N
Compound name
N,N-dimethyl-4-(1-methylquinolin-1-ium-2-yl)aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

263.15482 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.16210 164.2
[M+Na]+ 286.14404 172.1
[M-H]- 262.14754 172.1
[M+NH4]+ 281.18864 180.6
[M+K]+ 302.11798 162.2
[M+H-H2O]+ 246.15208 157.6
[M+HCOO]- 308.15302 186.6
[M+CH3COO]- 322.16867 199.4
[M+Na-2H]- 284.12949 172.7
[M]+ 263.15427 164.2
[M]- 263.15537 164.2
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

patents stripe