CID 50970

Brn 0434620

Structural Information

Molecular Formula
C20H21FN2O
SMILES
CCN(CC)CC(=O)C1=C(NC2=CC=CC=C21)C3=CC=C(C=C3)F
InChI
InChI=1S/C20H21FN2O/c1-3-23(4-2)13-18(24)19-16-7-5-6-8-17(16)22-20(19)14-9-11-15(21)12-10-14/h5-12,22H,3-4,13H2,1-2H3
InChIKey
ZRVNXRVIQQDSCA-UHFFFAOYSA-N
Compound name
2-(diethylamino)-1-[2-(4-fluorophenyl)-1H-indol-3-yl]ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

324.1638 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 325.17108 178.0
[M+Na]+ 347.15302 190.9
[M+NH4]+ 342.19762 185.3
[M+K]+ 363.12696 184.6
[M-H]- 323.15652 181.1
[M+Na-2H]- 345.13847 184.9
[M]+ 324.16325 180.6
[M]- 324.16435 180.6
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.