CID 45791027

1-(1,3-dimethylpyrrolidin-3-yl)-n-methylmethanamine

Structural Information

Molecular Formula

C₈H₁₈N₂

SMILES

CC1(CCN(C1)C)CNC

InChI

InChI=1S/C8H18N2/c1-8(6-9-2)4-5-10(3)7-8/h9H,4-7H2,1-3H3

InChIKey

VOBHWILMARPNBN-UHFFFAOYSA-N

Compound name

1-(1,3-dimethylpyrrolidin-3-yl)-N-methylmethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 142.147 Da
Monoisotopic Mass: 0.6
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]+	143.15428	131.8
[M+Na]+	165.13622	138.5
[M-H]-	141.13972	133.9
[M+NH4]+	160.18082	155.7
[M+K]+	181.11016	137.6
[M+H-H2O]+	125.14426	126.4
[M+HCOO]-	187.14520	154.3
[M+CH3COO]-	201.16085	177.3
[M+Na-2H]-	163.12167	137.1
[M]+	142.14645	129.6
[M]-	142.14755	129.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe