CID 3049422

Brn 1822307

Structural Information

Molecular Formula
C10H3Cl2N5
SMILES
C1=C(C=C(C(=C1Cl)NN=C(C#N)C#N)Cl)C#N
InChI
InChI=1S/C10H3Cl2N5/c11-8-1-6(3-13)2-9(12)10(8)17-16-7(4-14)5-15/h1-2,17H
InChIKey
NDMWMZSLWASAMA-UHFFFAOYSA-N
Compound name
2-[(2,6-dichloro-4-cyanophenyl)hydrazinylidene]propanedinitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

262.97656 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.98384 170.9
[M+Na]+ 285.96578 179.4
[M-H]- 261.96928 174.9
[M+NH4]+ 281.01038 178.1
[M+K]+ 301.93972 175.5
[M+H-H2O]+ 245.97382 159.0
[M+HCOO]- 307.97476 174.3
[M+CH3COO]- 321.99041 240.5
[M+Na-2H]- 283.95123 169.3
[M]+ 262.97601 164.2
[M]- 262.97711 164.2
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.