CID 82123

Benzenamine, n,n-dimethyl-4-[2-(1-oxido-2-pyridinyl)diazenyl]-

Structural Information

Molecular Formula
C13H14N4O
SMILES
CN(C)C1=CC=C(C=C1)N=NC2=CC=CC=[N+]2[O-]
InChI
InChI=1S/C13H14N4O/c1-16(2)12-8-6-11(7-9-12)14-15-13-5-3-4-10-17(13)18/h3-10H,1-2H3
InChIKey
LVGWWPXLMKGCHW-UHFFFAOYSA-N
Compound name
N,N-dimethyl-4-[(1-oxidopyridin-1-ium-2-yl)diazenyl]aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

37
Patents

242.11676 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 243.12404 152.9
[M+Na]+ 265.10598 168.1
[M+NH4]+ 260.15058 161.9
[M+K]+ 281.07992 162.4
[M-H]- 241.10948 160.7
[M+Na-2H]- 263.09143 163.8
[M]+ 242.11621 157.3
[M]- 242.11731 157.3
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

patents stripe