CID 5274981

[4-(9h-fluoren-9-yl)piperazin-1-yl]-indolin-5-yl-methanone

Structural Information

Molecular Formula
C26H25N3O
SMILES
C1CNC2=C1C=C(C=C2)C(=O)N3CCN(CC3)C4C5=CC=CC=C5C6=CC=CC=C46
InChI
InChI=1S/C26H25N3O/c30-26(19-9-10-24-18(17-19)11-12-27-24)29-15-13-28(14-16-29)25-22-7-3-1-5-20(22)21-6-2-4-8-23(21)25/h1-10,17,25,27H,11-16H2
InChIKey
PYCVVXNPWJGKMB-UHFFFAOYSA-N
Compound name
2,3-dihydro-1H-indol-5-yl-[4-(9H-fluoren-9-yl)piperazin-1-yl]methanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

395.19977 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 396.20705 195.8
[M+Na]+ 418.18899 200.8
[M-H]- 394.19249 202.1
[M+NH4]+ 413.23359 207.6
[M+K]+ 434.16293 192.1
[M+H-H2O]+ 378.19703 184.6
[M+HCOO]- 440.19797 206.0
[M+CH3COO]- 454.21362 202.8
[M+Na-2H]- 416.17444 193.0
[M]+ 395.19922 189.6
[M]- 395.20032 189.6
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.