CID 42647381

2-(4-fluorophenyl)azetidine

Structural Information

Molecular Formula
C9H10FN
SMILES
C1CNC1C2=CC=C(C=C2)F
InChI
InChI=1S/C9H10FN/c10-8-3-1-7(2-4-8)9-5-6-11-9/h1-4,9,11H,5-6H2
InChIKey
LWSFAJGOENYINQ-UHFFFAOYSA-N
Compound name
2-(4-fluorophenyl)azetidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

22
Patents

151.07973 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.08701 130.1
[M+Na]+ 174.06895 138.3
[M+NH4]+ 169.11355 135.0
[M+K]+ 190.04289 133.4
[M-H]- 150.07245 129.4
[M+Na-2H]- 172.05440 135.4
[M]+ 151.07918 129.8
[M]- 151.08028 129.8
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