CID 69083466

[6-(difluoromethoxy)pyridin-2-yl]methanol

Structural Information

Molecular Formula
C7H7F2NO2
SMILES
C1=CC(=NC(=C1)OC(F)F)CO
InChI
InChI=1S/C7H7F2NO2/c8-7(9)12-6-3-1-2-5(4-11)10-6/h1-3,7,11H,4H2
InChIKey
XCYVPSNADNRFPM-UHFFFAOYSA-N
Compound name
[6-(difluoromethoxy)pyridin-2-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

15
Patents

175.04448 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 176.05176 131.0
[M+Na]+ 198.03370 139.5
[M-H]- 174.03720 129.5
[M+NH4]+ 193.07830 149.1
[M+K]+ 214.00764 137.6
[M+H-H2O]+ 158.04174 123.0
[M+HCOO]- 220.04268 150.7
[M+CH3COO]- 234.05833 176.7
[M+Na-2H]- 196.01915 136.7
[M]+ 175.04393 129.1
[M]- 175.04503 129.1
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