CID 20587968

1108725-56-9

Structural Information

Molecular Formula
C8H10FN
SMILES
CC(C)C1=CN=C(C=C1)F
InChI
InChI=1S/C8H10FN/c1-6(2)7-3-4-8(9)10-5-7/h3-6H,1-2H3
InChIKey
KYUDTBPIZLFHNU-UHFFFAOYSA-N
Compound name
2-fluoro-5-propan-2-ylpyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

272
Patents

139.07973 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 140.08701 125.7
[M+Na]+ 162.06895 134.3
[M-H]- 138.07245 127.0
[M+NH4]+ 157.11355 146.4
[M+K]+ 178.04289 132.7
[M+H-H2O]+ 122.07699 118.9
[M+HCOO]- 184.07793 147.3
[M+CH3COO]- 198.09358 175.7
[M+Na-2H]- 160.05440 132.2
[M]+ 139.07918 124.4
[M]- 139.08028 124.4
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