CID 3018171

2-(hex-5-enyl)pyridine

Structural Information

Molecular Formula
C11H15N
SMILES
C=CCCCCC1=CC=CC=N1
InChI
InChI=1S/C11H15N/c1-2-3-4-5-8-11-9-6-7-10-12-11/h2,6-7,9-10H,1,3-5,8H2
InChIKey
ZYORITKNDAIZAN-UHFFFAOYSA-N
Compound name
2-hex-5-enylpyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

90
Patents

161.12045 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 162.127726 135.9
[M+Na]+ 184.109668 142.8
[M-H]- 160.113174 137.6
[M+NH4]+ 179.154273 155.4
[M+K]+ 200.083608 139.8
[M+H-H2O]+ 144.117710 129.2
[M+HCOO]- 206.118651 158.8
[M+CH3COO]- 220.134301 179.3
[M+Na-2H]- 182.095116 143.3
[M]+ 161.11990142 136.4
[M]- 161.12099858 136.4
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