CID 64665568

4-(3-fluorophenyl)azetidin-2-one

Structural Information

Molecular Formula
C9H8FNO
SMILES
C1C(NC1=O)C2=CC(=CC=C2)F
InChI
InChI=1S/C9H8FNO/c10-7-3-1-2-6(4-7)8-5-9(12)11-8/h1-4,8H,5H2,(H,11,12)
InChIKey
LOAYRAKRRRBRPG-UHFFFAOYSA-N
Compound name
4-(3-fluorophenyl)azetidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

165.05899 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.06627 129.1
[M+Na]+ 188.04821 136.8
[M-H]- 164.05171 132.1
[M+NH4]+ 183.09281 141.5
[M+K]+ 204.02215 136.4
[M+H-H2O]+ 148.05625 116.9
[M+HCOO]- 210.05719 148.6
[M+CH3COO]- 224.07284 179.1
[M+Na-2H]- 186.03366 134.7
[M]+ 165.05844 133.9
[M]- 165.05954 133.9
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