CID 53483110

1015236-33-5

Structural Information

Molecular Formula
C9H8F2O
SMILES
C1=CC=C(C=C1)COC=C(F)F
InChI
InChI=1S/C9H8F2O/c10-9(11)7-12-6-8-4-2-1-3-5-8/h1-5,7H,6H2
InChIKey
MTJZTMZOKIIDNV-UHFFFAOYSA-N
Compound name
2,2-difluoroethenoxymethylbenzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

170.05432 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 171.061596 131.7
[M+Na]+ 193.043538 139.2
[M-H]- 169.047044 132.5
[M+NH4]+ 188.088143 151.9
[M+K]+ 209.017478 136.9
[M+H-H2O]+ 153.051580 124.2
[M+HCOO]- 215.052521 153.6
[M+CH3COO]- 229.068171 178.2
[M+Na-2H]- 191.028986 137.5
[M]+ 170.05377142 129.3
[M]- 170.05486858 129.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.