CID 197750

2022-20-0

Structural Information

Molecular Formula
C23H25FN2O2
SMILES
C1CN(CCC1C2(CCC(=O)NC2=O)C3=CC=CC=C3)CC4=CC=C(C=C4)F
InChI
InChI=1S/C23H25FN2O2/c24-20-8-6-17(7-9-20)16-26-14-11-19(12-15-26)23(18-4-2-1-3-5-18)13-10-21(27)25-22(23)28/h1-9,19H,10-16H2,(H,25,27,28)
InChIKey
VTMACVBTDNAUST-UHFFFAOYSA-N
Compound name
3-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-3-phenylpiperidine-2,6-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

380.19 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 381.19728 195.3
[M+Na]+ 403.17922 199.0
[M-H]- 379.18272 200.9
[M+NH4]+ 398.22382 204.1
[M+K]+ 419.15316 191.6
[M+H-H2O]+ 363.18726 182.0
[M+HCOO]- 425.18820 205.8
[M+CH3COO]- 439.20385 201.7
[M+Na-2H]- 401.16467 194.0
[M]+ 380.18945 184.8
[M]- 380.19055 184.8
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.