CID 12092052

Benzidine diimine

Structural Information

Molecular Formula
C12H10N4
SMILES
C1=CC(=CC=C1C2=CC=C(C=C2)N=N)N=N
InChI
InChI=1S/C12H10N4/c13-15-11-5-1-9(2-6-11)10-3-7-12(16-14)8-4-10/h1-8,13-14H
InChIKey
JSDZLUVNBPEQDJ-UHFFFAOYSA-N
Compound name
[4-(4-diazenylphenyl)phenyl]diazene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

5
Patents

210.09055 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.097826 142.5
[M+Na]+ 233.079768 149.9
[M-H]- 209.083274 152.5
[M+NH4]+ 228.124373 161.3
[M+K]+ 249.053708 146.9
[M+H-H2O]+ 193.087810 134.0
[M+HCOO]- 255.088751 175.0
[M+CH3COO]- 269.104401 201.6
[M+Na-2H]- 231.065216 152.7
[M]+ 210.09000142 141.2
[M]- 210.09109858 141.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe