CID 46737253

3,5-difluoro-2-methoxypyridine

Structural Information

Molecular Formula
C6H5F2NO
SMILES
COC1=C(C=C(C=N1)F)F
InChI
InChI=1S/C6H5F2NO/c1-10-6-5(8)2-4(7)3-9-6/h2-3H,1H3
InChIKey
MEYHCABYUQUSKK-UHFFFAOYSA-N
Compound name
3,5-difluoro-2-methoxypyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

145.03392 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 146.041196 121.7
[M+Na]+ 168.023138 132.4
[M-H]- 144.026644 122.2
[M+NH4]+ 163.067743 142.4
[M+K]+ 183.997078 130.9
[M+H-H2O]+ 128.031180 114.2
[M+HCOO]- 190.032121 144.1
[M+CH3COO]- 204.047771 174.7
[M+Na-2H]- 166.008586 129.2
[M]+ 145.03337142 121.0
[M]- 145.03446858 121.0
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