CID 979474

F1345-0506

Structural Information

Molecular Formula
C24H19ClN2O2
SMILES
C1CN(CCN1C2=CC=C(C=C2)Cl)C(=O)C3=CC=CC4=C3C5=CC=CC=C5C4=O
InChI
InChI=1S/C24H19ClN2O2/c25-16-8-10-17(11-9-16)26-12-14-27(15-13-26)24(29)21-7-3-6-20-22(21)18-4-1-2-5-19(18)23(20)28/h1-11H,12-15H2
InChIKey
XSSLALNXKNXXTB-UHFFFAOYSA-N
Compound name
4-[4-(4-chlorophenyl)piperazine-1-carbonyl]fluoren-9-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

402.1135 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 403.120776 197.7
[M+Na]+ 425.102718 205.8
[M-H]- 401.106224 205.8
[M+NH4]+ 420.147323 209.7
[M+K]+ 441.076658 197.4
[M+H-H2O]+ 385.110760 186.8
[M+HCOO]- 447.111701 207.9
[M+CH3COO]- 461.127351 206.3
[M+Na-2H]- 423.088166 196.9
[M]+ 402.11295142 197.2
[M]- 402.11404858 197.2
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.