CID 62482251

1-(pyridazin-3-yl)piperidin-4-ol

Structural Information

Molecular Formula

C₉H₁₃N₃O

SMILES

C1CN(CCC1O)C2=NN=CC=C2

InChI

InChI=1S/C9H13N3O/c13-8-3-6-12(7-4-8)9-2-1-5-10-11-9/h1-2,5,8,13H,3-4,6-7H2

InChIKey

RCRQICJWNOGCOC-UHFFFAOYSA-N

Compound name

1-pyridazin-3-ylpiperidin-4-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 21
Patents: 179.10587 Da
Monoisotopic Mass: 0.2
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]+	180.11315	140.0
[M+Na]+	202.09509	152.9
[M+NH4]+	197.13969	147.8
[M+K]+	218.06903	146.6
[M-H]-	178.09859	142.1
[M+Na-2H]-	200.08054	147.6
[M]+	179.10532	142.3
[M]-	179.10642	142.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe