CID 72214457

5-(chloromethyl)-2-fluoro-4-methylpyridine

Structural Information

Molecular Formula
C7H7ClFN
SMILES
CC1=CC(=NC=C1CCl)F
InChI
InChI=1S/C7H7ClFN/c1-5-2-7(9)10-4-6(5)3-8/h2,4H,3H2,1H3
InChIKey
OMEMWFLFIQNVIK-UHFFFAOYSA-N
Compound name
5-(chloromethyl)-2-fluoro-4-methylpyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

159.0251 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.03238 127.0
[M+Na]+ 182.01432 141.7
[M+NH4]+ 177.05892 136.2
[M+K]+ 197.98826 134.0
[M-H]- 158.01782 128.2
[M+Na-2H]- 179.99977 134.9
[M]+ 159.02455 129.8
[M]- 159.02565 129.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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No literature data available for this compound.

Patent stripe

No patent data available for this compound.