CID 146081943

2-phenyl-2-(trifluoromethyl)azetidine

Structural Information

Molecular Formula
C10H10F3N
SMILES
C1CNC1(C2=CC=CC=C2)C(F)(F)F
InChI
InChI=1S/C10H10F3N/c11-10(12,13)9(6-7-14-9)8-4-2-1-3-5-8/h1-5,14H,6-7H2
InChIKey
PKAMTDBYUYVDHJ-UHFFFAOYSA-N
Compound name
2-phenyl-2-(trifluoromethyl)azetidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

201.07654 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.08382 149.2
[M+Na]+ 224.06576 154.5
[M+NH4]+ 219.11036 153.0
[M+K]+ 240.03970 148.7
[M-H]- 200.06926 144.8
[M+Na-2H]- 222.05121 153.3
[M]+ 201.07599 147.6
[M]- 201.07709 147.6
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.