CID 207818

Quinoline, 1,2-dihydro-1-trifluoroacetyl-

Structural Information

Molecular Formula
C11H8F3NO
SMILES
C1C=CC2=CC=CC=C2N1C(=O)C(F)(F)F
InChI
InChI=1S/C11H8F3NO/c12-11(13,14)10(16)15-7-3-5-8-4-1-2-6-9(8)15/h1-6H,7H2
InChIKey
BWLZUZVCVOPRLI-UHFFFAOYSA-N
Compound name
2,2,2-trifluoro-1-(2H-quinolin-1-yl)ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

227.0558 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 228.06308 149.2
[M+Na]+ 250.04502 159.1
[M+NH4]+ 245.08962 155.3
[M+K]+ 266.01896 153.5
[M-H]- 226.04852 146.3
[M+Na-2H]- 248.03047 153.5
[M]+ 227.05525 149.5
[M]- 227.05635 149.5
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.