CID 16740778

4-(piperazin-2-yl)phenol

Structural Information

Molecular Formula
C10H14N2O
SMILES
C1CNC(CN1)C2=CC=C(C=C2)O
InChI
InChI=1S/C10H14N2O/c13-9-3-1-8(2-4-9)10-7-11-5-6-12-10/h1-4,10-13H,5-7H2
InChIKey
SASIFHOHGBPKMK-UHFFFAOYSA-N
Compound name
4-piperazin-2-ylphenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

92
Patents

178.11061 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 179.117886 140.5
[M+Na]+ 201.099828 145.4
[M-H]- 177.103334 139.6
[M+NH4]+ 196.144433 155.3
[M+K]+ 217.073768 140.6
[M+H-H2O]+ 161.107870 132.9
[M+HCOO]- 223.108811 154.9
[M+CH3COO]- 237.124461 150.5
[M+Na-2H]- 199.085276 145.6
[M]+ 178.11006142 131.2
[M]- 178.11115858 131.2
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

patents stripe