CID 22935908

1-methyl-2-(pyrrolidin-2-yl)pyrrolidine

Structural Information

Molecular Formula

C₉H₁₈N₂

SMILES

CN1CCCC1C2CCCN2

InChI

InChI=1S/C9H18N2/c1-11-7-3-5-9(11)8-4-2-6-10-8/h8-10H,2-7H2,1H3

InChIKey

OWKCKFLYGJEUPI-UHFFFAOYSA-N

Compound name

1-methyl-2-pyrrolidin-2-ylpyrrolidine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 154.147 Da
Monoisotopic Mass: 0.9
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]+	155.15428	138.0
[M+Na]+	177.13622	142.9
[M-H]-	153.13972	139.8
[M+NH4]+	172.18082	158.8
[M+K]+	193.11016	140.9
[M+H-H2O]+	137.14426	130.5
[M+HCOO]-	199.14520	155.6
[M+CH3COO]-	213.16085	149.6
[M+Na-2H]-	175.12167	138.1
[M]+	154.14645	130.7
[M]-	154.14755	130.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe