CID 15293916

2-(3-fluorophenyl)oxirane

Structural Information

Molecular Formula
C8H7FO
SMILES
C1C(O1)C2=CC(=CC=C2)F
InChI
InChI=1S/C8H7FO/c9-7-3-1-2-6(4-7)8-5-10-8/h1-4,8H,5H2
InChIKey
HNBRZCKMGQHNJA-UHFFFAOYSA-N
Compound name
2-(3-fluorophenyl)oxirane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

189
Patents

138.0481 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 139.05538 121.1
[M+Na]+ 161.03732 131.9
[M-H]- 137.04082 128.7
[M+NH4]+ 156.08192 137.0
[M+K]+ 177.01126 130.9
[M+H-H2O]+ 121.04536 113.9
[M+HCOO]- 183.04630 144.8
[M+CH3COO]- 197.06195 176.3
[M+Na-2H]- 159.02277 130.3
[M]+ 138.04755 123.1
[M]- 138.04865 123.1
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

patents stripe