CID 208586

32524-37-1

Structural Information

Molecular Formula
C10H9Cl2N7
SMILES
C1=CC(=C(C=C1Cl)Cl)N=NC2=C(N=C(N=C2N)N)N
InChI
InChI=1S/C10H9Cl2N7/c11-4-1-2-6(5(12)3-4)18-19-7-8(13)16-10(15)17-9(7)14/h1-3H,(H6,13,14,15,16,17)
InChIKey
GELKBEAHMREOLC-UHFFFAOYSA-N
Compound name
5-[(2,4-dichlorophenyl)diazenyl]pyrimidine-2,4,6-triamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

297.02966 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 298.03694 168.1
[M+Na]+ 320.01888 179.1
[M-H]- 296.02238 173.9
[M+NH4]+ 315.06348 181.8
[M+K]+ 335.99282 173.0
[M+H-H2O]+ 280.02692 159.8
[M+HCOO]- 342.02786 187.6
[M+CH3COO]- 356.04351 216.3
[M+Na-2H]- 318.00433 172.8
[M]+ 297.02911 168.7
[M]- 297.03021 168.7
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.