CID 13670605

5-chloropyridazin-3-amine

Structural Information

Molecular Formula
C4H4ClN3
SMILES
C1=C(C=NN=C1N)Cl
InChI
InChI=1S/C4H4ClN3/c5-3-1-4(6)8-7-2-3/h1-2H,(H2,6,8)
InChIKey
FLLHRDDIQGNYLR-UHFFFAOYSA-N
Compound name
5-chloropyridazin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

150
Patents

129.00937 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.01665 120.3
[M+Na]+ 151.99859 130.6
[M-H]- 128.00209 121.1
[M+NH4]+ 147.04319 140.2
[M+K]+ 167.97253 127.4
[M+H-H2O]+ 112.00663 114.2
[M+HCOO]- 174.00757 139.5
[M+CH3COO]- 188.02322 170.7
[M+Na-2H]- 149.98404 129.3
[M]+ 129.00882 119.8
[M]- 129.00992 119.8
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