CID 16769132

1-[4-(difluoromethoxy)phenyl]ethan-1-ol

Structural Information

Molecular Formula
C9H10F2O2
SMILES
CC(C1=CC=C(C=C1)OC(F)F)O
InChI
InChI=1S/C9H10F2O2/c1-6(12)7-2-4-8(5-3-7)13-9(10)11/h2-6,9,12H,1H3
InChIKey
RGSDDQLZKOJWLR-UHFFFAOYSA-N
Compound name
1-[4-(difluoromethoxy)phenyl]ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

32
Patents

188.06488 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 189.072156 136.2
[M+Na]+ 211.054098 143.7
[M-H]- 187.057604 136.0
[M+NH4]+ 206.098703 155.2
[M+K]+ 227.028038 142.0
[M+H-H2O]+ 171.062140 129.0
[M+HCOO]- 233.063081 155.6
[M+CH3COO]- 247.078731 181.0
[M+Na-2H]- 209.039546 139.6
[M]+ 188.06433142 133.9
[M]- 188.06542858 133.9
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

patents stripe