CID 18001963

1098624-48-6

Structural Information

Molecular Formula

C₁₁H₂₃N₃

SMILES

C1CCN(C1)CCN2CCC(CC2)N

InChI

InChI=1S/C11H23N3/c12-11-3-7-14(8-4-11)10-9-13-5-1-2-6-13/h11H,1-10,12H2

InChIKey

HQDHTMDENAJVQN-UHFFFAOYSA-N

Compound name

1-(2-pyrrolidin-1-ylethyl)piperidin-4-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 18
Patents: 197.1892 Da
Monoisotopic Mass: 0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	198.19648	149.1
[M+Na]+	220.17842	151.8
[M-H]-	196.18192	150.8
[M+NH4]+	215.22302	166.4
[M+K]+	236.15236	149.3
[M+H-H2O]+	180.18646	140.3
[M+HCOO]-	242.18740	165.7
[M+CH3COO]-	256.20305	185.4
[M+Na-2H]-	218.16387	149.7
[M]+	197.18865	140.4
[M]-	197.18975	140.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe