CID 105271

66104-46-9

Structural Information

Molecular Formula
C13H15N5
SMILES
CC1=C(C=C(C=C1)N=NC2=C(N=C(C=C2)N)N)C
InChI
InChI=1S/C13H15N5/c1-8-3-4-10(7-9(8)2)17-18-11-5-6-12(14)16-13(11)15/h3-7H,1-2H3,(H4,14,15,16)
InChIKey
XDTUFOYIXSUYLG-UHFFFAOYSA-N
Compound name
3-[(3,4-dimethylphenyl)diazenyl]pyridine-2,6-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

241.13275 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.14003 155.5
[M+Na]+ 264.12197 164.2
[M-H]- 240.12547 163.7
[M+NH4]+ 259.16657 171.9
[M+K]+ 280.09591 160.7
[M+H-H2O]+ 224.13001 146.3
[M+HCOO]- 286.13095 184.9
[M+CH3COO]- 300.14660 208.7
[M+Na-2H]- 262.10742 161.6
[M]+ 241.13220 154.5
[M]- 241.13330 154.5
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.