CID 293516

102259-70-1

Structural Information

Molecular Formula
C15H14F6N2O
SMILES
CN(C)C1=CC2=C(C=C1)N=C(C=C2)CC(C(F)(F)F)(C(F)(F)F)O
InChI
InChI=1S/C15H14F6N2O/c1-23(2)11-5-6-12-9(7-11)3-4-10(22-12)8-13(24,14(16,17)18)15(19,20)21/h3-7,24H,8H2,1-2H3
InChIKey
AWILFNKHRQWBNJ-UHFFFAOYSA-N
Compound name
2-[[6-(dimethylamino)quinolin-2-yl]methyl]-1,1,1,3,3,3-hexafluoropropan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

352.10104 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 353.10832 178.7
[M+Na]+ 375.09026 183.0
[M+NH4]+ 370.13486 180.2
[M+K]+ 391.06420 179.8
[M-H]- 351.09376 172.0
[M+Na-2H]- 373.07571 179.2
[M]+ 352.10049 177.0
[M]- 352.10159 177.0
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.