CID 10822

4-ethylpyridine

Structural Information

Molecular Formula
C7H9N
SMILES
CCC1=CC=NC=C1
InChI
InChI=1S/C7H9N/c1-2-7-3-5-8-6-4-7/h3-6H,2H2,1H3
InChIKey
VJXRKZJMGVSXPX-UHFFFAOYSA-N
Compound name
4-ethylpyridine
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

20
References

11588
Patents

107.0735 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 108.08078 119.5
[M+Na]+ 130.06272 133.7
[M+NH4]+ 125.10732 129.3
[M+K]+ 146.03666 126.3
[M-H]- 106.06622 122.2
[M+Na-2H]- 128.04817 128.5
[M]+ 107.07295 122.4
[M]- 107.07405 122.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe