CID 9589148

2,6-dimethyl-1-(((4-(dimethylamino)phenyl)methylene)amino)pyridinium perchlorate

Structural Information

Molecular Formula
C16H20N3
SMILES
CC1=[N+](C(=CC=C1)C)/N=C/C2=CC=C(C=C2)N(C)C
InChI
InChI=1S/C16H20N3/c1-13-6-5-7-14(2)19(13)17-12-15-8-10-16(11-9-15)18(3)4/h5-12H,1-4H3/q+1/b17-12+
InChIKey
JOMRPOOEDHJXSE-SFQUDFHCSA-N
Compound name
4-[(E)-(2,6-dimethylpyridin-1-ium-1-yl)iminomethyl]-N,N-dimethylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

254.16573 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 255.17301 161.5
[M+Na]+ 277.15495 169.1
[M-H]- 253.15845 170.1
[M+NH4]+ 272.19955 178.0
[M+K]+ 293.12889 160.6
[M+H-H2O]+ 237.16299 155.0
[M+HCOO]- 299.16393 187.7
[M+CH3COO]- 313.17958 201.5
[M+Na-2H]- 275.14040 169.0
[M]+ 254.16518 162.6
[M]- 254.16628 162.6
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.