CID 91811920

2093582-30-8

Structural Information

Molecular Formula
C11H16N4
SMILES
C1CCN(C1)C2=NN=C3CCNCC3=C2
InChI
InChI=1S/C11H16N4/c1-2-6-15(5-1)11-7-9-8-12-4-3-10(9)13-14-11/h7,12H,1-6,8H2
InChIKey
LKRGJCLIGROITR-UHFFFAOYSA-N
Compound name
3-pyrrolidin-1-yl-5,6,7,8-tetrahydropyrido[4,3-c]pyridazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

204.1375 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.14478 147.7
[M+Na]+ 227.12672 153.5
[M-H]- 203.13022 147.4
[M+NH4]+ 222.17132 162.8
[M+K]+ 243.10066 149.0
[M+H-H2O]+ 187.13476 137.6
[M+HCOO]- 249.13570 161.0
[M+CH3COO]- 263.15135 157.4
[M+Na-2H]- 225.11217 151.9
[M]+ 204.13695 140.2
[M]- 204.13805 140.2
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.