CID 137778

Pyridine, 2-(1-butylpentyl)-

Structural Information

Molecular Formula
C14H23N
SMILES
CCCCC(CCCC)C1=CC=CC=N1
InChI
InChI=1S/C14H23N/c1-3-5-9-13(10-6-4-2)14-11-7-8-12-15-14/h7-8,11-13H,3-6,9-10H2,1-2H3
InChIKey
YGCMUHWPXXEZCR-UHFFFAOYSA-N
Compound name
2-nonan-5-ylpyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

47
Patents

205.18304 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.19032 151.7
[M+Na]+ 228.17226 156.7
[M-H]- 204.17576 152.8
[M+NH4]+ 223.21686 169.4
[M+K]+ 244.14620 154.0
[M+H-H2O]+ 188.18030 144.3
[M+HCOO]- 250.18124 172.3
[M+CH3COO]- 264.19689 190.0
[M+Na-2H]- 226.15771 156.1
[M]+ 205.18249 153.3
[M]- 205.18359 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

No literature data available for this compound.

Patent stripe

No patent data available for this compound.