CID 186651

Tetrachloropyridin-2-amine

Structural Information

Molecular Formula
C5H2Cl4N2
SMILES
C1(=C(C(=NC(=C1Cl)Cl)N)Cl)Cl
InChI
InChI=1S/C5H2Cl4N2/c6-1-2(7)4(9)11-5(10)3(1)8/h(H2,10,11)
InChIKey
UNFHNOMCUBAGRI-UHFFFAOYSA-N
Compound name
3,4,5,6-tetrachloropyridin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

229.8972 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 230.90448 140.5
[M+Na]+ 252.88642 152.2
[M-H]- 228.88992 139.6
[M+NH4]+ 247.93102 157.9
[M+K]+ 268.86036 146.4
[M+H-H2O]+ 212.89446 137.5
[M+HCOO]- 274.89540 144.1
[M+CH3COO]- 288.91105 191.1
[M+Na-2H]- 250.87187 143.0
[M]+ 229.89665 140.7
[M]- 229.89775 140.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe