CID 15681629

1-(difluoromethoxy)-2-fluorobenzene

Structural Information

Molecular Formula
C7H5F3O
SMILES
C1=CC=C(C(=C1)OC(F)F)F
InChI
InChI=1S/C7H5F3O/c8-5-3-1-2-4-6(5)11-7(9)10/h1-4,7H
InChIKey
WNXSLMDVLZECHU-UHFFFAOYSA-N
Compound name
1-(difluoromethoxy)-2-fluorobenzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

114
Patents

162.02925 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 163.03653 134.0
[M+Na]+ 185.01847 144.2
[M+NH4]+ 180.06307 140.7
[M+K]+ 200.99241 138.4
[M-H]- 161.02197 132.0
[M+Na-2H]- 183.00392 139.2
[M]+ 162.02870 134.6
[M]- 162.02980 134.6
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

patents stripe