CID 71299624

2-ethynyl-3-fluoro-5-methylpyridine

Structural Information

Molecular Formula
C8H6FN
SMILES
CC1=CC(=C(N=C1)C#C)F
InChI
InChI=1S/C8H6FN/c1-3-8-7(9)4-6(2)5-10-8/h1,4-5H,2H3
InChIKey
RRWWIECDYMJKNF-UHFFFAOYSA-N
Compound name
2-ethynyl-3-fluoro-5-methylpyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

135.04843 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 136.05571 127.0
[M+Na]+ 158.03765 140.6
[M+NH4]+ 153.08225 131.9
[M+K]+ 174.01159 130.5
[M-H]- 134.04115 119.8
[M+Na-2H]- 156.02310 131.3
[M]+ 135.04788 126.1
[M]- 135.04898 126.1
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

No patent data available for this compound.