CID 3053134

Of 71

Structural Information

Molecular Formula
C14H29N3
SMILES
CCN(CC)CCNCC1CC2CCN1CC2
InChI
InChI=1S/C14H29N3/c1-3-16(4-2)10-7-15-12-14-11-13-5-8-17(14)9-6-13/h13-15H,3-12H2,1-2H3
InChIKey
VFOKXMSTGSPNOF-UHFFFAOYSA-N
Compound name
N-(1-azabicyclo[2.2.2]octan-2-ylmethyl)-N',N'-diethylethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

239.23615 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 240.24343 155.9
[M+Na]+ 262.22537 163.2
[M+NH4]+ 257.26997 165.9
[M+K]+ 278.19931 155.6
[M-H]- 238.22887 155.1
[M+Na-2H]- 260.21082 153.5
[M]+ 239.23560 156.4
[M]- 239.23670 156.4
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.