CID 3046906

Piperidine, 1-(2-((1,4-diphenyl-1h-pyrazol-3-yl)oxy)ethyl)-, monohydrochloride

Structural Information

Molecular Formula
C22H25N3O
SMILES
C1CCN(CC1)CCOC2=NN(C=C2C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C22H25N3O/c1-4-10-19(11-5-1)21-18-25(20-12-6-2-7-13-20)23-22(21)26-17-16-24-14-8-3-9-15-24/h1-2,4-7,10-13,18H,3,8-9,14-17H2
InChIKey
KAICFNMVYGQKPX-UHFFFAOYSA-N
Compound name
1-[2-(1,4-diphenylpyrazol-3-yl)oxyethyl]piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

347.19977 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 348.20705 187.3
[M+Na]+ 370.18899 202.3
[M+NH4]+ 365.23359 195.4
[M+K]+ 386.16293 194.4
[M-H]- 346.19249 194.3
[M+Na-2H]- 368.17444 198.1
[M]+ 347.19922 191.5
[M]- 347.20032 191.5
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.