CID 28924765

2-(pyridazin-4-yl)ethan-1-amine dihydrochloride

Structural Information

Molecular Formula
C6H9N3
SMILES
C1=CN=NC=C1CCN
InChI
InChI=1S/C6H9N3/c7-3-1-6-2-4-8-9-5-6/h2,4-5H,1,3,7H2
InChIKey
XLHRTJGOOHOOGQ-UHFFFAOYSA-N
Compound name
2-pyridazin-4-ylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

17
Patents

123.07965 Da
Monoisotopic Mass

-1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 124.08693 123.5
[M+Na]+ 146.06887 131.5
[M-H]- 122.07237 124.0
[M+NH4]+ 141.11347 142.6
[M+K]+ 162.04281 129.6
[M+H-H2O]+ 106.07691 116.3
[M+HCOO]- 168.07785 146.9
[M+CH3COO]- 182.09350 171.7
[M+Na-2H]- 144.05432 132.9
[M]+ 123.07910 121.6
[M]- 123.08020 121.6
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