CID 61057953

1-(1-ethylpiperidin-4-yl)-1,4-diazepane

Structural Information

Molecular Formula
C12H25N3
SMILES
CCN1CCC(CC1)N2CCCNCC2
InChI
InChI=1S/C12H25N3/c1-2-14-9-4-12(5-10-14)15-8-3-6-13-7-11-15/h12-13H,2-11H2,1H3
InChIKey
GCKRQIOWUMFJIF-UHFFFAOYSA-N
Compound name
1-(1-ethylpiperidin-4-yl)-1,4-diazepane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

211.20485 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.21213 153.7
[M+Na]+ 234.19407 161.6
[M+NH4]+ 229.23867 160.5
[M+K]+ 250.16801 156.7
[M-H]- 210.19757 155.2
[M+Na-2H]- 232.17952 158.0
[M]+ 211.20430 155.0
[M]- 211.20540 155.0
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.