CID 80483147

2-cyclopropyl-1-(5-fluoropyridin-3-yl)ethan-1-one

Structural Information

Molecular Formula
C10H10FNO
SMILES
C1CC1CC(=O)C2=CC(=CN=C2)F
InChI
InChI=1S/C10H10FNO/c11-9-4-8(5-12-6-9)10(13)3-7-1-2-7/h4-7H,1-3H2
InChIKey
FAPSJQLOAXLSJO-UHFFFAOYSA-N
Compound name
2-cyclopropyl-1-(5-fluoropyridin-3-yl)ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

179.07465 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 180.08193 141.4
[M+Na]+ 202.06387 154.6
[M+NH4]+ 197.10847 149.6
[M+K]+ 218.03781 149.7
[M-H]- 178.06737 149.4
[M+Na-2H]- 200.04932 150.6
[M]+ 179.07410 146.5
[M]- 179.07520 146.5
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.