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]+ 166.066266 129.1
[M+Na]+ 188.048208 136.8
[M-H]- 164.051714 132.1
[M+NH4]+ 183.092813 141.5
[M+K]+ 204.022148 136.4
[M+H-H2O]+ 148.056250 116.9
[M+HCOO]- 210.057191 148.6
[M+CH3COO]- 224.072841 179.1
[M+Na-2H]- 186.033656 134.7
[M]+ 165.05844142 133.9
[M]- 165.05953858 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