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
4
Annotation Hits

36
References

2970
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 160.1
[M+Na]+ 275.15186 162.8
[M-H]- 251.15536 163.9
[M+NH4]+ 270.19646 172.2
[M+K]+ 291.12580 157.1
[M+H-H2O]+ 235.15990 149.7
[M+HCOO]- 297.16084 175.2
[M+CH3COO]- 311.17649 168.9
[M+Na-2H]- 273.13731 164.5
[M]+ 252.16209 151.6
[M]- 252.16319 151.6
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.