CID 91657019

1443341-74-9

Structural Information

Molecular Formula
C11H14F2O2
SMILES
CC(C)COC1=C(C(=CC(=C1)CO)F)F
InChI
InChI=1S/C11H14F2O2/c1-7(2)6-15-10-4-8(5-14)3-9(12)11(10)13/h3-4,7,14H,5-6H2,1-2H3
InChIKey
SMBVQAKGNBFKPW-UHFFFAOYSA-N
Compound name
[3,4-difluoro-5-(2-methylpropoxy)phenyl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

216.09619 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 217.10347 149.1
[M+Na]+ 239.08541 159.6
[M+NH4]+ 234.13001 155.4
[M+K]+ 255.05935 153.9
[M-H]- 215.08891 147.6
[M+Na-2H]- 237.07086 152.9
[M]+ 216.09564 149.9
[M]- 216.09674 149.9
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.