CID 130737502

5-bromo-6-chloropyridazin-4-amine

Structural Information

Molecular Formula
C4H3BrClN3
SMILES
C1=C(C(=C(N=N1)Cl)Br)N
InChI
InChI=1S/C4H3BrClN3/c5-3-2(7)1-8-9-4(3)6/h1H,(H2,7,9)
InChIKey
UZOJBBFOEJTCGP-UHFFFAOYSA-N
Compound name
5-bromo-6-chloropyridazin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

206.91989 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.927166 127.0
[M+Na]+ 229.909108 141.4
[M-H]- 205.912614 130.9
[M+NH4]+ 224.953713 147.7
[M+K]+ 245.883048 128.8
[M+H-H2O]+ 189.917150 126.9
[M+HCOO]- 251.918091 144.1
[M+CH3COO]- 265.933741 182.4
[M+Na-2H]- 227.894556 136.6
[M]+ 206.91934142 145.5
[M]- 206.92043858 145.5
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.