CID 3045001

Piperazine, 1-(2-ethoxy-2-(3-pyridyl)ethyl)-4-phenyl-

Structural Information

Molecular Formula
C19H25N3O
SMILES
CCOC(CN1CCN(CC1)C2=CC=CC=C2)C3=CN=CC=C3
InChI
InChI=1S/C19H25N3O/c1-2-23-19(17-7-6-10-20-15-17)16-21-11-13-22(14-12-21)18-8-4-3-5-9-18/h3-10,15,19H,2,11-14,16H2,1H3
InChIKey
AHEPDULQXFTSOW-UHFFFAOYSA-N
Compound name
1-(2-ethoxy-2-pyridin-3-ylethyl)-4-phenylpiperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

311.19977 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 312.20705 177.8
[M+Na]+ 334.18899 191.8
[M+NH4]+ 329.23359 185.4
[M+K]+ 350.16293 183.2
[M-H]- 310.19249 182.8
[M+Na-2H]- 332.17444 187.2
[M]+ 311.19922 181.2
[M]- 311.20032 181.2
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

No patent data available for this compound.