CID 85630598

Octanamide, n-(5-amino-2-methylpentyl)-

Structural Information

Molecular Formula
C14H30N2O
SMILES
CCCCCCCC(=O)NCC(C)CCCN
InChI
InChI=1S/C14H30N2O/c1-3-4-5-6-7-10-14(17)16-12-13(2)9-8-11-15/h13H,3-12,15H2,1-2H3,(H,16,17)
InChIKey
STLNLXPRSJHIPV-UHFFFAOYSA-N
Compound name
N-(5-amino-2-methylpentyl)octanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

242.23581 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 243.24309 164.6
[M+Na]+ 265.22503 170.5
[M+NH4]+ 260.26963 170.3
[M+K]+ 281.19897 164.8
[M-H]- 241.22853 164.0
[M+Na-2H]- 263.21048 165.2
[M]+ 242.23526 164.7
[M]- 242.23636 164.7
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