CID 24721640

2-(3,4-difluorophenyl)-1,3-dioxolane

Structural Information

Molecular Formula
C9H8F2O2
SMILES
C1COC(O1)C2=CC(=C(C=C2)F)F
InChI
InChI=1S/C9H8F2O2/c10-7-2-1-6(5-8(7)11)9-12-3-4-13-9/h1-2,5,9H,3-4H2
InChIKey
JDIKHNSLOQHKLX-UHFFFAOYSA-N
Compound name
2-(3,4-difluorophenyl)-1,3-dioxolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

186.04924 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 187.056516 133.4
[M+Na]+ 209.038458 142.3
[M-H]- 185.041964 139.1
[M+NH4]+ 204.083063 152.4
[M+K]+ 225.012398 142.2
[M+H-H2O]+ 169.046500 126.4
[M+HCOO]- 231.047441 153.9
[M+CH3COO]- 245.063091 179.4
[M+Na-2H]- 207.023906 138.9
[M]+ 186.04869142 131.4
[M]- 186.04978858 131.4
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