CID 14718340

7077-55-6

Structural Information

Molecular Formula
C14H17N4
SMILES
C[N+]1=CC=CC=C1N=NC2=CC=C(C=C2)N(C)C
InChI
InChI=1S/C14H17N4/c1-17(2)13-9-7-12(8-10-13)15-16-14-6-4-5-11-18(14)3/h4-11H,1-3H3/q+1
InChIKey
XOHQNMQTOOLXSR-UHFFFAOYSA-N
Compound name
N,N-dimethyl-4-[(1-methylpyridin-1-ium-2-yl)diazenyl]aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

39
Patents

241.14532 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.15260 155.5
[M+Na]+ 264.13454 162.5
[M-H]- 240.13804 165.4
[M+NH4]+ 259.17914 172.5
[M+K]+ 280.10848 155.4
[M+H-H2O]+ 224.14258 148.4
[M+HCOO]- 286.14352 184.9
[M+CH3COO]- 300.15917 201.9
[M+Na-2H]- 262.11999 165.8
[M]+ 241.14477 156.6
[M]- 241.14587 156.6
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

patents stripe