CID 131504052

Refchem:544809

Structural Information

Molecular Formula
C10H8F2N2
SMILES
CC1=C(C=C2C=CC(=C(C2=N1)F)F)N
InChI
InChI=1S/C10H8F2N2/c1-5-8(13)4-6-2-3-7(11)9(12)10(6)14-5/h2-4H,13H2,1H3
InChIKey
FIUWFJYKWQMAJA-UHFFFAOYSA-N
Compound name
7,8-difluoro-2-methylquinolin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

28
Patents

194.06555 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.072826 137.3
[M+Na]+ 217.054768 148.9
[M-H]- 193.058274 138.6
[M+NH4]+ 212.099373 156.9
[M+K]+ 233.028708 144.4
[M+H-H2O]+ 177.062810 129.2
[M+HCOO]- 239.063751 158.4
[M+CH3COO]- 253.079401 188.6
[M+Na-2H]- 215.040216 143.5
[M]+ 194.06500142 134.5
[M]- 194.06609858 134.5
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

patents stripe