CID 5053516

N-(4-methylbenzylidene)-3-(trifluoromethyl)aniline

Structural Information

Molecular Formula
C15H12F3N
SMILES
CC1=CC=C(C=C1)C=NC2=CC=CC(=C2)C(F)(F)F
InChI
InChI=1S/C15H12F3N/c1-11-5-7-12(8-6-11)10-19-14-4-2-3-13(9-14)15(16,17)18/h2-10H,1H3
InChIKey
WHWYHNGBWSRPOH-UHFFFAOYSA-N
Compound name
1-(4-methylphenyl)-N-[3-(trifluoromethyl)phenyl]methanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

263.0922 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.09948 156.3
[M+Na]+ 286.08142 165.1
[M-H]- 262.08492 160.7
[M+NH4]+ 281.12602 173.5
[M+K]+ 302.05536 160.2
[M+H-H2O]+ 246.08946 146.2
[M+HCOO]- 308.09040 178.2
[M+CH3COO]- 322.10605 201.1
[M+Na-2H]- 284.06687 161.9
[M]+ 263.09165 152.9
[M]- 263.09275 152.9
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.