CID 200334

1526-65-4

Structural Information

Molecular Formula
C20H22F3NO
SMILES
C1CCN(C1)CCOC(C2=CC=CC=C2)C3=CC(=CC=C3)C(F)(F)F
InChI
InChI=1S/C20H22F3NO/c21-20(22,23)18-10-6-9-17(15-18)19(16-7-2-1-3-8-16)25-14-13-24-11-4-5-12-24/h1-3,6-10,15,19H,4-5,11-14H2
InChIKey
OXZBMTDAPMORBJ-UHFFFAOYSA-N
Compound name
1-[2-[phenyl-[3-(trifluoromethyl)phenyl]methoxy]ethyl]pyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

349.16534 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 350.17262 186.3
[M+Na]+ 372.15456 195.2
[M+NH4]+ 367.19916 191.8
[M+K]+ 388.12850 189.6
[M-H]- 348.15806 186.3
[M+Na-2H]- 370.14001 191.9
[M]+ 349.16479 187.3
[M]- 349.16589 187.3
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.