CID 11781336

N-(1-(4-methoxyphenyl)ethylidene)-2-(trifluoromethyl)aniline

Structural Information

Molecular Formula
C16H14F3NO
SMILES
CC(=NC1=CC=CC=C1C(F)(F)F)C2=CC=C(C=C2)OC
InChI
InChI=1S/C16H14F3NO/c1-11(12-7-9-13(21-2)10-8-12)20-15-6-4-3-5-14(15)16(17,18)19/h3-10H,1-2H3
InChIKey
SELLEVWVNJOCAM-UHFFFAOYSA-N
Compound name
1-(4-methoxyphenyl)-N-[2-(trifluoromethyl)phenyl]ethanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

293.10275 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 294.11003 164.5
[M+Na]+ 316.09197 172.4
[M-H]- 292.09547 168.8
[M+NH4]+ 311.13657 180.3
[M+K]+ 332.06591 168.4
[M+H-H2O]+ 276.10001 154.1
[M+HCOO]- 338.10095 185.3
[M+CH3COO]- 352.11660 207.0
[M+Na-2H]- 314.07742 168.4
[M]+ 293.10220 162.2
[M]- 293.10330 162.2
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