CID 832946

Propanedinitrile, ((4-cyanophenyl)hydrazono)-

Structural Information

Molecular Formula
C10H5N5
SMILES
C1=CC(=CC=C1C#N)NN=C(C#N)C#N
InChI
InChI=1S/C10H5N5/c11-5-8-1-3-9(4-2-8)14-15-10(6-12)7-13/h1-4,14H
InChIKey
FMYMDEPLLXDYGC-UHFFFAOYSA-N
Compound name
2-[(4-cyanophenyl)hydrazinylidene]propanedinitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

195.05449 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.061766 169.0
[M+Na]+ 218.043708 176.0
[M-H]- 194.047214 172.9
[M+NH4]+ 213.088313 176.3
[M+K]+ 234.017648 173.4
[M+H-H2O]+ 178.051750 155.5
[M+HCOO]- 240.052691 175.6
[M+CH3COO]- 254.068341 236.9
[M+Na-2H]- 216.029156 168.0
[M]+ 195.05394142 160.5
[M]- 195.05503858 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

No patent data available for this compound.