CID 54390282

2460749-58-8

Structural Information

Molecular Formula
C10H7F3N2
SMILES
C1=CC=C2C(=C1)C=C(C(=N2)C(F)(F)F)N
InChI
InChI=1S/C10H7F3N2/c11-10(12,13)9-7(14)5-6-3-1-2-4-8(6)15-9/h1-5H,14H2
InChIKey
OGKZZXVXLZCMQW-UHFFFAOYSA-N
Compound name
2-(trifluoromethyl)quinolin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

15
Patents

212.05614 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.06342 142.4
[M+Na]+ 235.04536 152.9
[M+NH4]+ 230.08996 149.0
[M+K]+ 251.01930 147.2
[M-H]- 211.04886 140.8
[M+Na-2H]- 233.03081 147.9
[M]+ 212.05559 143.2
[M]- 212.05669 143.2
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