CID 2741843

Ccg-47572

Structural Information

Molecular Formula
C23H20F3NO4
SMILES
CC(C(=O)NC1=CC=C(C=C1)OC)OC2=CC=C(C=C2)OC3=CC=C(C=C3)C(F)(F)F
InChI
InChI=1S/C23H20F3NO4/c1-15(22(28)27-17-5-9-18(29-2)10-6-17)30-19-11-13-21(14-12-19)31-20-7-3-16(4-8-20)23(24,25)26/h3-15H,1-2H3,(H,27,28)
InChIKey
CNGDXWNKGKXAJX-UHFFFAOYSA-N
Compound name
N-(4-methoxyphenyl)-2-[4-[4-(trifluoromethyl)phenoxy]phenoxy]propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

0
Patents

431.13443 Da
Monoisotopic Mass

5.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 432.141706 200.7
[M+Na]+ 454.123648 206.3
[M-H]- 430.127154 206.2
[M+NH4]+ 449.168253 209.2
[M+K]+ 470.097588 202.2
[M+H-H2O]+ 414.131690 187.8
[M+HCOO]- 476.132631 218.2
[M+CH3COO]- 490.148281 229.5
[M+Na-2H]- 452.109096 201.4
[M]+ 431.13388142 200.3
[M]- 431.13497858 200.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.