CID 64798635

2-amino-3-(morpholin-4-yl)propan-1-ol dihydrochloride

Structural Information

Molecular Formula

C₇H₁₆N₂O₂

SMILES

C1COCCN1CC(CO)N

InChI

InChI=1S/C7H16N2O2/c8-7(6-10)5-9-1-3-11-4-2-9/h7,10H,1-6,8H2

InChIKey

VOAWUSVOUMQYKK-UHFFFAOYSA-N

Compound name

2-amino-3-morpholin-4-ylpropan-1-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 160.12119 Da
Monoisotopic Mass: -1.7
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]+	161.128466	137.0
[M+Na]+	183.110408	140.6
[M-H]-	159.113914	136.9
[M+NH4]+	178.155013	153.4
[M+K]+	199.084348	140.7
[M+H-H2O]+	143.118450	130.2
[M+HCOO]-	205.119391	153.9
[M+CH3COO]-	219.135041	175.5
[M+Na-2H]-	181.095856	141.6
[M]+	160.12064142	131.5
[M]-	160.12173858	131.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe