CID 118430534

Schembl17156238

Structural Information

Molecular Formula
C8H7F2N
SMILES
C1CC1C2=CC(=C(N=C2)F)F
InChI
InChI=1S/C8H7F2N/c9-7-3-6(5-1-2-5)4-11-8(7)10/h3-5H,1-2H2
InChIKey
POOCARFBMKQYHU-UHFFFAOYSA-N
Compound name
5-cyclopropyl-2,3-difluoropyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

155.05466 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.06194 126.4
[M+Na]+ 178.04388 137.9
[M-H]- 154.04738 130.7
[M+NH4]+ 173.08848 141.6
[M+K]+ 194.01782 134.4
[M+H-H2O]+ 138.05192 117.6
[M+HCOO]- 200.05286 148.5
[M+CH3COO]- 214.06851 180.7
[M+Na-2H]- 176.02933 133.1
[M]+ 155.05411 126.0
[M]- 155.05521 126.0
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