CID 70976976

(2,6-difluoro-3-iodophenyl)methanol

Structural Information

Molecular Formula
C7H5F2IO
SMILES
C1=CC(=C(C(=C1F)CO)F)I
InChI
InChI=1S/C7H5F2IO/c8-5-1-2-6(10)7(9)4(5)3-11/h1-2,11H,3H2
InChIKey
YFROSOVMRGMTQE-UHFFFAOYSA-N
Compound name
(2,6-difluoro-3-iodophenyl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

269.93533 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.94261 141.7
[M+Na]+ 292.92455 146.1
[M+NH4]+ 287.96915 144.9
[M+K]+ 308.89849 143.1
[M-H]- 268.92805 135.0
[M+Na-2H]- 290.91000 134.8
[M]+ 269.93478 139.2
[M]- 269.93588 139.2
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