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

1
Patents

380.17117 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 381.178446 189.8
[M+Na]+ 403.160388 194.1
[M-H]- 379.163894 191.8
[M+NH4]+ 398.204993 200.7
[M+K]+ 419.134328 189.6
[M+H-H2O]+ 363.168430 178.3
[M+HCOO]- 425.169371 207.9
[M+CH3COO]- 439.185021 224.3
[M+Na-2H]- 401.145836 190.5
[M]+ 380.17062142 187.1
[M]- 380.17171858 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