CID 3794561

2,3-difluoro-4-methoxybenzyl alcohol

Structural Information

Molecular Formula
C8H8F2O2
SMILES
COC1=C(C(=C(C=C1)CO)F)F
InChI
InChI=1S/C8H8F2O2/c1-12-6-3-2-5(4-11)7(9)8(6)10/h2-3,11H,4H2,1H3
InChIKey
SJKZXUYOJRZFKG-UHFFFAOYSA-N
Compound name
(2,3-difluoro-4-methoxyphenyl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

174.04924 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 175.05652 135.4
[M+Na]+ 197.03846 146.9
[M+NH4]+ 192.08306 142.4
[M+K]+ 213.01240 141.1
[M-H]- 173.04196 134.3
[M+Na-2H]- 195.02391 140.4
[M]+ 174.04869 136.5
[M]- 174.04979 136.5
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

No patent data available for this compound.