CID 88876

Pyridinium, 1-methyl-4-vinyl-, iodide

Structural Information

Molecular Formula
C8H10N
SMILES
C[N+]1=CC=C(C=C1)C=C
InChI
InChI=1S/C8H10N/c1-3-8-4-6-9(2)7-5-8/h3-7H,1H2,2H3/q+1
InChIKey
AJWDVSJQPIRAKK-UHFFFAOYSA-N
Compound name
4-ethenyl-1-methylpyridin-1-ium
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

5
References

1237
Patents

120.08132 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 121.08860 122.4
[M+Na]+ 143.07054 131.6
[M-H]- 119.07404 125.4
[M+NH4]+ 138.11514 143.7
[M+K]+ 159.04448 124.1
[M+H-H2O]+ 103.07858 119.5
[M+HCOO]- 165.07952 146.0
[M+CH3COO]- 179.09517 164.7
[M+Na-2H]- 141.05599 132.9
[M]+ 120.08077 121.0
[M]- 120.08187 121.0
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