CID 10290847

155601-17-5

Structural Information

Molecular Formula

C₅H₁₀N₄O

SMILES

C1=NN(C(=C1N)N)CCO

InChI

InChI=1S/C5H10N4O/c6-4-3-8-9(1-2-10)5(4)7/h3,10H,1-2,6-7H2

InChIKey

KDBUTNSQYYLYOY-UHFFFAOYSA-N

Compound name

2-(4,5-diaminopyrazol-1-yl)ethanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 7635
Patents: 142.08546 Da
Monoisotopic Mass: -1.5
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]+	143.092736	127.5
[M+Na]+	165.074678	136.2
[M-H]-	141.078184	127.0
[M+NH4]+	160.119283	146.8
[M+K]+	181.048618	134.1
[M+H-H2O]+	125.082720	120.6
[M+HCOO]-	187.083661	151.0
[M+CH3COO]-	201.099311	175.1
[M+Na-2H]-	163.060126	132.2
[M]+	142.08491142	124.4
[M]-	142.08600858	124.4

Literature stripe

literature stripe

Patent stripe

patents stripe