CID 2771747

2-biphenyl-4-yl-piperazine

Structural Information

Molecular Formula
C16H18N2
SMILES
C1CNC(CN1)C2=CC=C(C=C2)C3=CC=CC=C3
InChI
InChI=1S/C16H18N2/c1-2-4-13(5-3-1)14-6-8-15(9-7-14)16-12-17-10-11-18-16/h1-9,16-18H,10-12H2
InChIKey
QUINYTMXFWCKTN-UHFFFAOYSA-N
Compound name
2-(4-phenylphenyl)piperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

33
Patents

238.147 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.15428 158.6
[M+Na]+ 261.13622 173.2
[M+NH4]+ 256.18082 167.6
[M+K]+ 277.11016 164.3
[M-H]- 237.13972 164.2
[M+Na-2H]- 259.12167 168.8
[M]+ 238.14645 162.3
[M]- 238.14755 162.3
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