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]+ 179.12912 139.5
[M+Na]+ 201.11106 146.1
[M-H]- 177.11456 137.9
[M+NH4]+ 196.15566 155.5
[M+K]+ 217.08500 142.2
[M+H-H2O]+ 161.11910 131.1
[M+HCOO]- 223.12004 156.6
[M+CH3COO]- 237.13569 150.3
[M+Na-2H]- 199.09651 148.3
[M]+ 178.12129 134.7
[M]- 178.12239 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.