CID 9589006

Pyridinium, 2-bromo-1-(((4-(dimethylamino)phenyl)methylene)amino)-6-methyl-, perchlorate

Structural Information

Molecular Formula
C15H17BrN3
SMILES
CC1=[N+](C(=CC=C1)Br)/N=C/C2=CC=C(C=C2)N(C)C
InChI
InChI=1S/C15H17BrN3/c1-12-5-4-6-15(16)19(12)17-11-13-7-9-14(10-8-13)18(2)3/h4-11H,1-3H3/q+1/b17-11+
InChIKey
ITOWDSTYGQWVMV-GZTJUZNOSA-N
Compound name
4-[(E)-(2-bromo-6-methylpyridin-1-ium-1-yl)iminomethyl]-N,N-dimethylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

318.06058 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 319.06786 164.2
[M+Na]+ 341.04980 170.9
[M+NH4]+ 336.09440 170.2
[M+K]+ 357.02374 169.4
[M-H]- 317.05330 169.9
[M+Na-2H]- 339.03525 171.4
[M]+ 318.06003 166.0
[M]- 318.06113 166.0
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.