CID 45051282

853331-17-6

Structural Information

Molecular Formula
C20H20FN3
SMILES
CN(C)CCNC1=C2CC3=C(C2=NC4=CC=CC=C41)C=CC(=C3)F
InChI
InChI=1S/C20H20FN3/c1-24(2)10-9-22-19-16-5-3-4-6-18(16)23-20-15-8-7-14(21)11-13(15)12-17(19)20/h3-8,11H,9-10,12H2,1-2H3,(H,22,23)
InChIKey
TXSHDIICQGHFPZ-UHFFFAOYSA-N
Compound name
N-(2-fluoro-11H-indeno[1,2-b]quinolin-10-yl)-N',N'-dimethylethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

321.16412 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 322.17140 174.7
[M+Na]+ 344.15334 183.3
[M-H]- 320.15684 179.8
[M+NH4]+ 339.19794 192.9
[M+K]+ 360.12728 177.3
[M+H-H2O]+ 304.16138 165.1
[M+HCOO]- 366.16232 195.7
[M+CH3COO]- 380.17797 185.8
[M+Na-2H]- 342.13879 180.1
[M]+ 321.16357 176.3
[M]- 321.16467 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.