CID 8366407

Piperazine, p2

Structural Information

Molecular Formula
C24H22N2O
SMILES
C1CN(CCN1C2C3=CC=CC=C3C4=CC=CC=C24)C(=O)C5=CC=CC=C5
InChI
InChI=1S/C24H22N2O/c27-24(18-8-2-1-3-9-18)26-16-14-25(15-17-26)23-21-12-6-4-10-19(21)20-11-5-7-13-22(20)23/h1-13,23H,14-17H2
InChIKey
VLBOIQVSYAIHBX-UHFFFAOYSA-N
Compound name
[4-(9H-fluoren-9-yl)piperazin-1-yl]-phenylmethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

4
Patents

354.17322 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 355.18050 186.7
[M+Na]+ 377.16244 192.2
[M-H]- 353.16594 194.3
[M+NH4]+ 372.20704 199.4
[M+K]+ 393.13638 184.7
[M+H-H2O]+ 337.17048 175.2
[M+HCOO]- 399.17142 201.3
[M+CH3COO]- 413.18707 195.3
[M+Na-2H]- 375.14789 187.8
[M]+ 354.17267 182.2
[M]- 354.17377 182.2
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