CID 70048

1-benzhydrylpiperazine

Structural Information

Molecular Formula
C17H20N2
SMILES
C1CN(CCN1)C(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C17H20N2/c1-3-7-15(8-4-1)17(16-9-5-2-6-10-16)19-13-11-18-12-14-19/h1-10,17-18H,11-14H2
InChIKey
NWVNXDKZIQLBNM-UHFFFAOYSA-N
Compound name
1-benzhydrylpiperazine
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

36
References

2597
Patents

252.16264 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 253.16992 162.5
[M+Na]+ 275.15186 176.7
[M+NH4]+ 270.19646 171.5
[M+K]+ 291.12580 167.9
[M-H]- 251.15536 168.4
[M+Na-2H]- 273.13731 173.0
[M]+ 252.16209 166.2
[M]- 252.16319 166.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe