CID 201021

Brn 0116496

Structural Information

Molecular Formula
C14H31N3
SMILES
CCN(CC)CCNCC1CCCC(N1C)C
InChI
InChI=1S/C14H31N3/c1-5-17(6-2)11-10-15-12-14-9-7-8-13(3)16(14)4/h13-15H,5-12H2,1-4H3
InChIKey
ILJAQSPNZACVTF-UHFFFAOYSA-N
Compound name
N-[(1,6-dimethylpiperidin-2-yl)methyl]-N',N'-diethylethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

241.2518 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.25908 164.1
[M+Na]+ 264.24102 166.5
[M-H]- 240.24452 166.1
[M+NH4]+ 259.28562 180.6
[M+K]+ 280.21496 165.3
[M+H-H2O]+ 224.24906 156.0
[M+HCOO]- 286.25000 183.8
[M+CH3COO]- 300.26565 205.8
[M+Na-2H]- 262.22647 165.0
[M]+ 241.25125 162.5
[M]- 241.25235 162.5
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.