CID 63075626

3-(3,4,5-trifluorophenyl)pyrrolidine

Structural Information

Molecular Formula
C10H10F3N
SMILES
C1CNCC1C2=CC(=C(C(=C2)F)F)F
InChI
InChI=1S/C10H10F3N/c11-8-3-7(4-9(12)10(8)13)6-1-2-14-5-6/h3-4,6,14H,1-2,5H2
InChIKey
HHSDWOQIXNBUGL-UHFFFAOYSA-N
Compound name
3-(3,4,5-trifluorophenyl)pyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

201.07654 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.08382 147.6
[M+Na]+ 224.06576 157.0
[M+NH4]+ 219.11036 154.0
[M+K]+ 240.03970 152.2
[M-H]- 200.06926 146.2
[M+Na-2H]- 222.05121 151.6
[M]+ 201.07599 148.1
[M]- 201.07709 148.1
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

No patent data available for this compound.