CID 18621161

313345-08-3

Structural Information

Molecular Formula
C9H21N3
SMILES
CN(C)C1CCN(CC1)CCN
InChI
InChI=1S/C9H21N3/c1-11(2)9-3-6-12(7-4-9)8-5-10/h9H,3-8,10H2,1-2H3
InChIKey
XYIUIYHRNFXKQF-UHFFFAOYSA-N
Compound name
1-(2-aminoethyl)-N,N-dimethylpiperidin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

38
Patents

171.17355 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 172.18083 142.0
[M+Na]+ 194.16277 145.6
[M-H]- 170.16627 144.1
[M+NH4]+ 189.20737 160.8
[M+K]+ 210.13671 145.3
[M+H-H2O]+ 154.17081 134.6
[M+HCOO]- 216.17175 162.7
[M+CH3COO]- 230.18740 188.7
[M+Na-2H]- 192.14822 145.2
[M]+ 171.17300 137.2
[M]- 171.17410 137.2
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

patents stripe