CID 19418944

6-fluoro-1h,2h,3h,4h,5h-pyrido[4,3-b]indole hydrochloride

Structural Information

Molecular Formula
C11H11FN2
SMILES
C1CNCC2=C1NC3=C2C=CC=C3F
InChI
InChI=1S/C11H11FN2/c12-9-3-1-2-7-8-6-13-5-4-10(8)14-11(7)9/h1-3,13-14H,4-6H2
InChIKey
WFOAZAKVBMIMKT-UHFFFAOYSA-N
Compound name
6-fluoro-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

55
Patents

190.09062 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.09790 137.8
[M+Na]+ 213.07984 147.4
[M-H]- 189.08334 136.9
[M+NH4]+ 208.12444 157.6
[M+K]+ 229.05378 141.1
[M+H-H2O]+ 173.08788 130.3
[M+HCOO]- 235.08882 154.2
[M+CH3COO]- 249.10447 149.8
[M+Na-2H]- 211.06529 144.5
[M]+ 190.09007 132.6
[M]- 190.09117 132.6
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

patents stripe