CID 167518

2,5-divinylpyridine

Structural Information

Molecular Formula
C9H9N
SMILES
C=CC1=CN=C(C=C1)C=C
InChI
InChI=1S/C9H9N/c1-3-8-5-6-9(4-2)10-7-8/h3-7H,1-2H2
InChIKey
SXLIFQSDMYZOBA-UHFFFAOYSA-N
Compound name
2,5-bis(ethenyl)pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

176
Patents

131.0735 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 132.080776 124.6
[M+Na]+ 154.062718 133.7
[M-H]- 130.066224 127.1
[M+NH4]+ 149.107323 145.6
[M+K]+ 170.036658 130.6
[M+H-H2O]+ 114.070760 118.7
[M+HCOO]- 176.071701 148.3
[M+CH3COO]- 190.087351 173.4
[M+Na-2H]- 152.048166 132.5
[M]+ 131.07295142 124.1
[M]- 131.07404858 124.1
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