CID 13899584

2,5-dibenzylpiperazine

Structural Information

Molecular Formula
C18H22N2
SMILES
C1C(NCC(N1)CC2=CC=CC=C2)CC3=CC=CC=C3
InChI
InChI=1S/C18H22N2/c1-3-7-15(8-4-1)11-17-13-20-18(14-19-17)12-16-9-5-2-6-10-16/h1-10,17-20H,11-14H2
InChIKey
MHZXGSQZAQYQPG-UHFFFAOYSA-N
Compound name
2,5-dibenzylpiperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

266.17828 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 267.18556 164.9
[M+Na]+ 289.16750 168.0
[M-H]- 265.17100 167.4
[M+NH4]+ 284.21210 176.2
[M+K]+ 305.14144 160.7
[M+H-H2O]+ 249.17554 154.7
[M+HCOO]- 311.17648 179.2
[M+CH3COO]- 325.19213 173.1
[M+Na-2H]- 287.15295 168.7
[M]+ 266.17773 156.0
[M]- 266.17883 156.0
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