CID 55284669

1-(3-aminopyrazol-1-yl)propan-2-ol

Structural Information

Molecular Formula

C₆H₁₁N₃O

SMILES

CC(CN1C=CC(=N1)N)O

InChI

InChI=1S/C6H11N3O/c1-5(10)4-9-3-2-6(7)8-9/h2-3,5,10H,4H2,1H3,(H2,7,8)

InChIKey

QJCMYUTUCCCBMY-UHFFFAOYSA-N

Compound name

1-(3-aminopyrazol-1-yl)propan-2-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 11
Patents: 141.09021 Da
Monoisotopic Mass: -0.4
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	128.9
[M+Na]+	164.07943	138.3
[M+NH4]+	159.12403	135.8
[M+K]+	180.05337	136.2
[M-H]-	140.08293	128.5
[M+Na-2H]-	162.06488	133.1
[M]+	141.08966	129.6
[M]-	141.09076	129.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe