CID 76296

4-(5-nonyl)pyridine

Structural Information

Molecular Formula
C14H23N
SMILES
CCCCC(CCCC)C1=CC=NC=C1
InChI
InChI=1S/C14H23N/c1-3-5-7-13(8-6-4-2)14-9-11-15-12-10-14/h9-13H,3-8H2,1-2H3
InChIKey
ATCGHKBXRIOBDX-UHFFFAOYSA-N
Compound name
4-nonan-5-ylpyridine
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

2411
Patents

205.18304 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.190316 151.7
[M+Na]+ 228.172258 156.7
[M-H]- 204.175764 152.8
[M+NH4]+ 223.216863 169.4
[M+K]+ 244.146198 154.0
[M+H-H2O]+ 188.180300 144.3
[M+HCOO]- 250.181241 172.3
[M+CH3COO]- 264.196891 190.0
[M+Na-2H]- 226.157706 156.1
[M]+ 205.18249142 153.3
[M]- 205.18358858 153.3
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