CID 218109

40256-88-0

Structural Information

Molecular Formula
C20H23F3N2O2
SMILES
CCNC1=CC=C(C=C1)OCC(=O)NC(C)CC2=CC(=CC=C2)C(F)(F)F
InChI
InChI=1S/C20H23F3N2O2/c1-3-24-17-7-9-18(10-8-17)27-13-19(26)25-14(2)11-15-5-4-6-16(12-15)20(21,22)23/h4-10,12,14,24H,3,11,13H2,1-2H3,(H,25,26)
InChIKey
NLWIUERCGRBCOI-UHFFFAOYSA-N
Compound name
2-[4-(ethylamino)phenoxy]-N-[1-[3-(trifluoromethyl)phenyl]propan-2-yl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

380.17117 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 381.17845 189.8
[M+Na]+ 403.16039 194.1
[M-H]- 379.16389 191.8
[M+NH4]+ 398.20499 200.7
[M+K]+ 419.13433 189.6
[M+H-H2O]+ 363.16843 178.3
[M+HCOO]- 425.16937 207.9
[M+CH3COO]- 439.18502 224.3
[M+Na-2H]- 401.14584 190.5
[M]+ 380.17062 187.1
[M]- 380.17172 187.1
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