CID 21459699

185107-64-6

Structural Information

Molecular Formula
C6H2Cl2N2
SMILES
C1=CC(=C(N=C1C#N)Cl)Cl
InChI
InChI=1S/C6H2Cl2N2/c7-5-2-1-4(3-9)10-6(5)8/h1-2H
InChIKey
PDRSZXQBFCYYKZ-UHFFFAOYSA-N
Compound name
5,6-dichloropyridine-2-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

171.9595 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 172.96678 128.4
[M+Na]+ 194.94872 141.7
[M-H]- 170.95222 130.2
[M+NH4]+ 189.99332 147.0
[M+K]+ 210.92266 136.3
[M+H-H2O]+ 154.95676 117.6
[M+HCOO]- 216.95770 140.2
[M+CH3COO]- 230.97335 189.7
[M+Na-2H]- 192.93417 135.2
[M]+ 171.95895 125.9
[M]- 171.96005 125.9
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

patents stripe