CID 3052369

6-fluoro-2-(4-fluorophenyl)-3-(2-(4-morpholinyl)ethyl)-1h-indole

Structural Information

Molecular Formula
C20H20F2N2O
SMILES
C1COCCN1CCC2=C(NC3=C2C=CC(=C3)F)C4=CC=C(C=C4)F
InChI
InChI=1S/C20H20F2N2O/c21-15-3-1-14(2-4-15)20-18(7-8-24-9-11-25-12-10-24)17-6-5-16(22)13-19(17)23-20/h1-6,13,23H,7-12H2
InChIKey
HYAROOVBDVKXBE-UHFFFAOYSA-N
Compound name
4-[2-[6-fluoro-2-(4-fluorophenyl)-1H-indol-3-yl]ethyl]morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

342.15436 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 343.16164 180.4
[M+Na]+ 365.14358 188.5
[M-H]- 341.14708 184.9
[M+NH4]+ 360.18818 191.6
[M+K]+ 381.11752 181.5
[M+H-H2O]+ 325.15162 168.6
[M+HCOO]- 387.15256 194.6
[M+CH3COO]- 401.16821 189.6
[M+Na-2H]- 363.12903 181.2
[M]+ 342.15381 176.3
[M]- 342.15491 176.3
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.