CID 53613701

2126162-01-2

Structural Information

Molecular Formula
C9H14N4
SMILES
CCNC1=NN=C2CCNCC2=C1
InChI
InChI=1S/C9H14N4/c1-2-11-9-5-7-6-10-4-3-8(7)12-13-9/h5,10H,2-4,6H2,1H3,(H,11,13)
InChIKey
LBHRMKQRUZNCFD-UHFFFAOYSA-N
Compound name
N-ethyl-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

178.12184 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 179.129116 139.5
[M+Na]+ 201.111058 146.1
[M-H]- 177.114564 137.9
[M+NH4]+ 196.155663 155.5
[M+K]+ 217.084998 142.2
[M+H-H2O]+ 161.119100 131.1
[M+HCOO]- 223.120041 156.6
[M+CH3COO]- 237.135691 150.3
[M+Na-2H]- 199.096506 148.3
[M]+ 178.12129142 134.7
[M]- 178.12238858 134.7
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.