CID 45051342

853350-19-3

Structural Information

Molecular Formula
C17H16F3N
SMILES
CCC1=CC=C(C=C1)C(=NC2=CC=CC=C2C(F)(F)F)C
InChI
InChI=1S/C17H16F3N/c1-3-13-8-10-14(11-9-13)12(2)21-16-7-5-4-6-15(16)17(18,19)20/h4-11H,3H2,1-2H3
InChIKey
WWBLNBKDFOPUOZ-UHFFFAOYSA-N
Compound name
1-(4-ethylphenyl)-N-[2-(trifluoromethyl)phenyl]ethanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

291.12347 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 292.13075 165.6
[M+Na]+ 314.11269 173.2
[M-H]- 290.11619 169.7
[M+NH4]+ 309.15729 181.5
[M+K]+ 330.08663 168.3
[M+H-H2O]+ 274.12073 155.2
[M+HCOO]- 336.12167 185.8
[M+CH3COO]- 350.13732 208.0
[M+Na-2H]- 312.09814 168.9
[M]+ 291.12292 162.3
[M]- 291.12402 162.3
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.