CID 20545467

72828-89-8

Structural Information

Molecular Formula
C14H16N4
SMILES
CC1=CC=C(C=C1)N=NC2=C(C=C(C(=C2)C)N)N
InChI
InChI=1S/C14H16N4/c1-9-3-5-11(6-4-9)17-18-14-7-10(2)12(15)8-13(14)16/h3-8H,15-16H2,1-2H3
InChIKey
ROKSGXMXOHYETP-UHFFFAOYSA-N
Compound name
4-methyl-6-[(4-methylphenyl)diazenyl]benzene-1,3-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

240.1375 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.14478 156.6
[M+Na]+ 263.12672 169.4
[M+NH4]+ 258.17132 165.3
[M+K]+ 279.10066 161.7
[M-H]- 239.13022 164.3
[M+Na-2H]- 261.11217 166.1
[M]+ 240.13695 160.5
[M]- 240.13805 160.5
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

patents stripe