CID 132372769

4-(1h-pyrazol-5-yl)piperidin-4-ol

Structural Information

Molecular Formula
C8H13N3O
SMILES
C1CNCCC1(C2=CC=NN2)O
InChI
InChI=1S/C8H13N3O/c12-8(2-5-9-6-3-8)7-1-4-10-11-7/h1,4,9,12H,2-3,5-6H2,(H,10,11)
InChIKey
VOQHIEDNNJKFMY-UHFFFAOYSA-N
Compound name
4-(1H-pyrazol-5-yl)piperidin-4-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

167.10587 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.113146 137.6
[M+Na]+ 190.095088 143.3
[M-H]- 166.098594 135.7
[M+NH4]+ 185.139693 155.0
[M+K]+ 206.069028 139.5
[M+H-H2O]+ 150.103130 129.8
[M+HCOO]- 212.104071 152.2
[M+CH3COO]- 226.119721 147.9
[M+Na-2H]- 188.080536 142.6
[M]+ 167.10532142 128.7
[M]- 167.10641858 128.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.