CID 71755572

3-ethyl-3,9-diazabicyclo[4.2.1]nonane

Structural Information

Molecular Formula
C9H18N2
SMILES
CCN1CCC2CCC(C1)N2
InChI
InChI=1S/C9H18N2/c1-2-11-6-5-8-3-4-9(7-11)10-8/h8-10H,2-7H2,1H3
InChIKey
LIWDBILSDMYGHH-UHFFFAOYSA-N
Compound name
3-ethyl-3,9-diazabicyclo[4.2.1]nonane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

154.147 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.15428 131.8
[M+Na]+ 177.13622 139.3
[M+NH4]+ 172.18082 139.9
[M+K]+ 193.11016 136.7
[M-H]- 153.13972 131.4
[M+Na-2H]- 175.12167 134.0
[M]+ 154.14645 132.5
[M]- 154.14755 132.5
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.