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

20
Patents

145.03392 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 146.04120 121.7
[M+Na]+ 168.02314 132.4
[M-H]- 144.02664 122.2
[M+NH4]+ 163.06774 142.4
[M+K]+ 183.99708 130.9
[M+H-H2O]+ 128.03118 114.2
[M+HCOO]- 190.03212 144.1
[M+CH3COO]- 204.04777 174.7
[M+Na-2H]- 166.00859 129.2
[M]+ 145.03337 121.0
[M]- 145.03447 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