CID 59634618

8-fluoro-2-methylquinolin-3-amine

Structural Information

Molecular Formula
C10H9FN2
SMILES
CC1=C(C=C2C=CC=C(C2=N1)F)N
InChI
InChI=1S/C10H9FN2/c1-6-9(12)5-7-3-2-4-8(11)10(7)13-6/h2-5H,12H2,1H3
InChIKey
IARKJQHRKMYCBU-UHFFFAOYSA-N
Compound name
8-fluoro-2-methylquinolin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

47
Patents

176.07498 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 177.082256 134.2
[M+Na]+ 199.064198 144.8
[M-H]- 175.067704 136.5
[M+NH4]+ 194.108803 154.3
[M+K]+ 215.038138 140.8
[M+H-H2O]+ 159.072240 126.9
[M+HCOO]- 221.073181 156.4
[M+CH3COO]- 235.088831 147.9
[M+Na-2H]- 197.049646 141.8
[M]+ 176.07443142 132.2
[M]- 176.07552858 132.2
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

patents stripe