CID 2322794

4-amino-3,5,6-trichloropyridine-2-carbohydrazide

Structural Information

Molecular Formula
C6H5Cl3N4O
SMILES
C1(=C(C(=NC(=C1Cl)Cl)C(=O)NN)Cl)N
InChI
InChI=1S/C6H5Cl3N4O/c7-1-3(10)2(8)5(9)12-4(1)6(14)13-11/h11H2,(H2,10,12)(H,13,14)
InChIKey
WTTWCEILJTYVET-UHFFFAOYSA-N
Compound name
4-amino-3,5,6-trichloropyridine-2-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

1
Patents

253.9529 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 254.96018 150.7
[M+Na]+ 276.94212 161.2
[M-H]- 252.94562 151.3
[M+NH4]+ 271.98672 166.9
[M+K]+ 292.91606 155.5
[M+H-H2O]+ 236.95016 146.8
[M+HCOO]- 298.95110 160.9
[M+CH3COO]- 312.96675 198.5
[M+Na-2H]- 274.92757 152.4
[M]+ 253.95235 150.4
[M]- 253.95345 150.4
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