CID 14374007

1-amino-3-(1h-imidazol-1-yl)propan-2-ol

Structural Information

Molecular Formula

C₆H₁₁N₃O

SMILES

C1=CN(C=N1)CC(CN)O

InChI

InChI=1S/C6H11N3O/c7-3-6(10)4-9-2-1-8-5-9/h1-2,5-6,10H,3-4,7H2

InChIKey

IPLIJMUJLJBZDZ-UHFFFAOYSA-N

Compound name

1-amino-3-imidazol-1-ylpropan-2-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 33
Patents: 141.09021 Da
Monoisotopic Mass: -1.6
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]+	142.09749	129.0
[M+Na]+	164.07943	138.0
[M+NH4]+	159.12403	135.9
[M+K]+	180.05337	135.7
[M-H]-	140.08293	128.5
[M+Na-2H]-	162.06488	133.4
[M]+	141.08966	129.6
[M]-	141.09076	129.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe