CID 550646

2138133-16-9

Structural Information

Molecular Formula

C₆H₁₄N₂

SMILES

CNCC1CCCN1

InChI

InChI=1S/C6H14N2/c1-7-5-6-3-2-4-8-6/h6-8H,2-5H2,1H3

InChIKey

HFRAIQDUWJODKF-UHFFFAOYSA-N

Compound name

N-methyl-1-pyrrolidin-2-ylmethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 234
Patents: 114.1157 Da
Monoisotopic Mass: -0.1
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	125.2
[M+Na]+	137.104918	130.4
[M-H]-	113.108424	125.4
[M+NH4]+	132.149523	147.1
[M+K]+	153.078858	129.0
[M+H-H2O]+	97.112960	119.0
[M+HCOO]-	159.113901	146.7
[M+CH3COO]-	173.129551	167.9
[M+Na-2H]-	135.090366	130.5
[M]+	114.11515142	119.6
[M]-	114.11624858	119.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe