CID 14672276

1-(pyrrolidin-2-yl)ethan-1-amine

Structural Information

Molecular Formula

C₆H₁₄N₂

SMILES

CC(C1CCCN1)N

InChI

InChI=1S/C6H14N2/c1-5(7)6-3-2-4-8-6/h5-6,8H,2-4,7H2,1H3

InChIKey

KAEAOSROYJPPIZ-UHFFFAOYSA-N

Compound name

1-pyrrolidin-2-ylethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 126
Patents: 114.1157 Da
Monoisotopic Mass: -0.2
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]+	115.122976	126.5
[M+Na]+	137.104918	131.4
[M-H]-	113.108424	126.3
[M+NH4]+	132.149523	148.0
[M+K]+	153.078858	130.1
[M+H-H2O]+	97.112960	120.4
[M+HCOO]-	159.113901	146.3
[M+CH3COO]-	173.129551	168.1
[M+Na-2H]-	135.090366	129.4
[M]+	114.11515142	119.2
[M]-	114.11624858	119.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe