CID 10261056

(3r)-(+)-3-(methylamino)pyrrolidine

Structural Information

Molecular Formula

C₅H₁₂N₂

SMILES

CN[C@@H]1CCNC1

InChI

InChI=1S/C5H12N2/c1-6-5-2-3-7-4-5/h5-7H,2-4H2,1H3/t5-/m1/s1

InChIKey

NGZYRKGJWYJGRS-RXMQYKEDSA-N

Compound name

(3R)-N-methylpyrrolidin-3-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1769
Patents: 100.10005 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]+	101.10733	120.7
[M+Na]+	123.08927	126.3
[M-H]-	99.092774	121.1
[M+NH4]+	118.13387	143.1
[M+K]+	139.06321	125.2
[M+H-H2O]+	83.097310	114.7
[M+HCOO]-	145.09825	142.5
[M+CH3COO]-	159.11390	164.8
[M+Na-2H]-	121.07472	126.5
[M]+	100.09950	114.8
[M]-	100.10060	114.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe