CID 6484177

2-(3,5-dimethylpiperidin-1-yl)ethan-1-amine

Structural Information

Molecular Formula
C9H20N2
SMILES
CC1CC(CN(C1)CCN)C
InChI
InChI=1S/C9H20N2/c1-8-5-9(2)7-11(6-8)4-3-10/h8-9H,3-7,10H2,1-2H3
InChIKey
GQSWLZPKSPRYJI-UHFFFAOYSA-N
Compound name
2-(3,5-dimethylpiperidin-1-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

55
Patents

156.16264 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 157.16992 138.3
[M+Na]+ 179.15186 143.7
[M-H]- 155.15536 139.4
[M+NH4]+ 174.19646 157.8
[M+K]+ 195.12580 142.0
[M+H-H2O]+ 139.15990 131.9
[M+HCOO]- 201.16084 157.6
[M+CH3COO]- 215.17649 181.5
[M+Na-2H]- 177.13731 141.3
[M]+ 156.16209 133.4
[M]- 156.16319 133.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe