CID 21896830

2-amino-3-(dimethylamino)propan-1-ol dihydrochloride

Structural Information

Molecular Formula

C₅H₁₄N₂O

SMILES

CN(C)CC(CO)N

InChI

InChI=1S/C5H14N2O/c1-7(2)3-5(6)4-8/h5,8H,3-4,6H2,1-2H3

InChIKey

STUCHZYFEVRKGI-UHFFFAOYSA-N

Compound name

2-amino-3-(dimethylamino)propan-1-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 20
Patents: 118.11061 Da
Monoisotopic Mass: -1.3
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]+	119.11789	125.6
[M+Na]+	141.09983	133.3
[M+NH4]+	136.14443	133.1
[M+K]+	157.07377	129.7
[M-H]-	117.10333	125.6
[M+Na-2H]-	139.08528	128.6
[M]+	118.11006	126.2
[M]-	118.11116	126.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe