CID 58022208

1-(2,6-difluorophenyl)cyclobutan-1-ol

Structural Information

Molecular Formula
C10H10F2O
SMILES
C1CC(C1)(C2=C(C=CC=C2F)F)O
InChI
InChI=1S/C10H10F2O/c11-7-3-1-4-8(12)9(7)10(13)5-2-6-10/h1,3-4,13H,2,5-6H2
InChIKey
IABPSSJIZOJVSM-UHFFFAOYSA-N
Compound name
1-(2,6-difluorophenyl)cyclobutan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

184.06998 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.077256 134.6
[M+Na]+ 207.059198 142.7
[M-H]- 183.062704 138.1
[M+NH4]+ 202.103803 149.6
[M+K]+ 223.033138 142.3
[M+H-H2O]+ 167.067240 123.4
[M+HCOO]- 229.068181 153.8
[M+CH3COO]- 243.083831 182.5
[M+Na-2H]- 205.044646 139.9
[M]+ 184.06943142 139.1
[M]- 184.07052858 139.1
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