CID 21824841

4-fluoro-2,6-dimethylpyridine

Structural Information

Molecular Formula
C7H8FN
SMILES
CC1=CC(=CC(=N1)C)F
InChI
InChI=1S/C7H8FN/c1-5-3-7(8)4-6(2)9-5/h3-4H,1-2H3
InChIKey
DKTHUYYKGQCVEP-UHFFFAOYSA-N
Compound name
4-fluoro-2,6-dimethylpyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

28
Patents

125.06408 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 126.07136 120.2
[M+Na]+ 148.05330 130.5
[M-H]- 124.05680 122.0
[M+NH4]+ 143.09790 141.9
[M+K]+ 164.02724 128.8
[M+H-H2O]+ 108.06134 113.8
[M+HCOO]- 170.06228 143.2
[M+CH3COO]- 184.07793 172.9
[M+Na-2H]- 146.03875 127.8
[M]+ 125.06353 119.6
[M]- 125.06463 119.6
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