CID 97517

24749-07-3

Structural Information

Molecular Formula
C12H11Cl2N5
SMILES
CC1=C(C(=NC(=N1)N)C)N=NC2=C(C=C(C=C2)Cl)Cl
InChI
InChI=1S/C12H11Cl2N5/c1-6-11(7(2)17-12(15)16-6)19-18-10-4-3-8(13)5-9(10)14/h3-5H,1-2H3,(H2,15,16,17)
InChIKey
FGHVSOCUXFSNDR-UHFFFAOYSA-N
Compound name
5-[(2,4-dichlorophenyl)diazenyl]-4,6-dimethylpyrimidin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

295.03915 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.04643 164.4
[M+Na]+ 318.02837 180.4
[M+NH4]+ 313.07297 172.6
[M+K]+ 334.00231 171.6
[M-H]- 294.03187 170.1
[M+Na-2H]- 316.01382 173.9
[M]+ 295.03860 168.9
[M]- 295.03970 168.9
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.