CID 45051287

853328-17-3

Structural Information

Molecular Formula
C22H24FN3
SMILES
CCN(CC)CCNC1=C2CC3=C(C2=NC4=CC=CC=C41)C=CC(=C3)F
InChI
InChI=1S/C22H24FN3/c1-3-26(4-2)12-11-24-21-18-7-5-6-8-20(18)25-22-17-10-9-16(23)13-15(17)14-19(21)22/h5-10,13H,3-4,11-12,14H2,1-2H3,(H,24,25)
InChIKey
JMNPTIAPLYAUON-UHFFFAOYSA-N
Compound name
N',N'-diethyl-N-(2-fluoro-11H-indeno[1,2-b]quinolin-10-yl)ethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

349.19543 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 350.20271 184.1
[M+Na]+ 372.18465 191.7
[M-H]- 348.18815 188.7
[M+NH4]+ 367.22925 201.1
[M+K]+ 388.15859 185.2
[M+H-H2O]+ 332.19269 174.0
[M+HCOO]- 394.19363 204.3
[M+CH3COO]- 408.20928 194.2
[M+Na-2H]- 370.17010 188.3
[M]+ 349.19488 186.2
[M]- 349.19598 186.2
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.