CID 14272

3-vinylpyridine

Structural Information

Molecular Formula
C7H7N
SMILES
C=CC1=CN=CC=C1
InChI
InChI=1S/C7H7N/c1-2-7-4-3-5-8-6-7/h2-6H,1H2
InChIKey
DPZYLEIWHTWHCU-UHFFFAOYSA-N
Compound name
3-ethenylpyridine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

27
References

9196
Patents

105.057846 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 106.06512 117.3
[M+Na]+ 128.04706 125.9
[M-H]- 104.05057 119.7
[M+NH4]+ 123.09167 139.0
[M+K]+ 144.02100 124.0
[M+H-H2O]+ 88.055106 111.5
[M+HCOO]- 150.05605 141.5
[M+CH3COO]- 164.07170 167.1
[M+Na-2H]- 126.03251 126.9
[M]+ 105.05730 116.3
[M]- 105.05839 116.3
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.