CID 9588847

145234-97-5

Structural Information

Molecular Formula
C16H20N3
SMILES
CC1=C[N+](=C(C=C1)C)/N=C/C2=CC=C(C=C2)N(C)C
InChI
InChI=1S/C16H20N3/c1-13-5-6-14(2)19(12-13)17-11-15-7-9-16(10-8-15)18(3)4/h5-12H,1-4H3/q+1/b17-11+
InChIKey
QNHBDSOETFQKAZ-GZTJUZNOSA-N
Compound name
4-[(E)-(2,5-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 159.1
[M+Na]+ 277.15495 175.9
[M+NH4]+ 272.19955 169.1
[M+K]+ 293.12889 167.9
[M-H]- 253.15845 167.3
[M+Na-2H]- 275.14040 170.4
[M]+ 254.16518 164.3
[M]- 254.16628 164.3
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.