CID 45051280

853331-14-3

Structural Information

Molecular Formula
C21H19FN2
SMILES
C1CCN(CC1)C2=C3CC4=C(C3=NC5=CC=CC=C52)C=CC(=C4)F
InChI
InChI=1S/C21H19FN2/c22-15-8-9-16-14(12-15)13-18-20(16)23-19-7-3-2-6-17(19)21(18)24-10-4-1-5-11-24/h2-3,6-9,12H,1,4-5,10-11,13H2
InChIKey
TYBDOAFPHIOJFQ-UHFFFAOYSA-N
Compound name
2-fluoro-10-piperidin-1-yl-11H-indeno[1,2-b]quinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

318.15323 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 319.16051 175.7
[M+Na]+ 341.14245 183.7
[M-H]- 317.14595 180.3
[M+NH4]+ 336.18705 191.7
[M+K]+ 357.11639 175.5
[M+H-H2O]+ 301.15049 164.2
[M+HCOO]- 363.15143 189.3
[M+CH3COO]- 377.16708 185.2
[M+Na-2H]- 339.12790 178.4
[M]+ 318.15268 170.9
[M]- 318.15378 170.9
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.