CID 3146156

325986-22-9

Structural Information

Molecular Formula
C21H21NO2
SMILES
CC1CC(CN(C1)C(=O)C2=CC=CC3=C2C4=CC=CC=C4C3=O)C
InChI
InChI=1S/C21H21NO2/c1-13-10-14(2)12-22(11-13)21(24)18-9-5-8-17-19(18)15-6-3-4-7-16(15)20(17)23/h3-9,13-14H,10-12H2,1-2H3
InChIKey
XCBFQMOXSCFTNJ-UHFFFAOYSA-N
Compound name
4-(3,5-dimethylpiperidine-1-carbonyl)fluoren-9-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

10
References

0
Patents

319.15723 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 320.16451 177.2
[M+Na]+ 342.14645 184.9
[M-H]- 318.14995 184.1
[M+NH4]+ 337.19105 194.1
[M+K]+ 358.12039 179.0
[M+H-H2O]+ 302.15449 168.9
[M+HCOO]- 364.15543 193.4
[M+CH3COO]- 378.17108 187.8
[M+Na-2H]- 340.13190 176.8
[M]+ 319.15668 175.6
[M]- 319.15778 175.6
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

No patent data available for this compound.