CID 19969819

4-(dimethylamino)pyrrolidin-3-ol

Structural Information

Molecular Formula

C₆H₁₄N₂O

SMILES

CN(C)C1CNCC1O

InChI

InChI=1S/C6H14N2O/c1-8(2)5-3-7-4-6(5)9/h5-7,9H,3-4H2,1-2H3

InChIKey

CLMZWVXBYNBYDL-UHFFFAOYSA-N

Compound name

4-(dimethylamino)pyrrolidin-3-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 88
Patents: 130.11061 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]+	131.11789	128.2
[M+Na]+	153.09983	136.3
[M+NH4]+	148.14443	136.0
[M+K]+	169.07377	134.0
[M-H]-	129.10333	128.5
[M+Na-2H]-	151.08528	131.5
[M]+	130.11006	128.9
[M]-	130.11116	128.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe