CID 75355789

(8-fluoroquinolin-3-yl)methanamine

Structural Information

Molecular Formula
C10H9FN2
SMILES
C1=CC2=CC(=CN=C2C(=C1)F)CN
InChI
InChI=1S/C10H9FN2/c11-9-3-1-2-8-4-7(5-12)6-13-10(8)9/h1-4,6H,5,12H2
InChIKey
XEVYXTJXXQGUIR-UHFFFAOYSA-N
Compound name
(8-fluoroquinolin-3-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

176.07498 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 177.082256 133.9
[M+Na]+ 199.064198 143.6
[M-H]- 175.067704 135.8
[M+NH4]+ 194.108803 153.7
[M+K]+ 215.038138 139.5
[M+H-H2O]+ 159.072240 126.3
[M+HCOO]- 221.073181 156.2
[M+CH3COO]- 235.088831 147.3
[M+Na-2H]- 197.049646 142.3
[M]+ 176.07443142 131.5
[M]- 176.07552858 131.5
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.