CID 69414

Octanamide

Structural Information

Molecular Formula
C8H17NO
SMILES
CCCCCCCC(=O)N
InChI
InChI=1S/C8H17NO/c1-2-3-4-5-6-7-8(9)10/h2-7H2,1H3,(H2,9,10)
InChIKey
LTHCSWBWNVGEFE-UHFFFAOYSA-N
Compound name
octanamide
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

14
References

5975
Patents

143.13101 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.13829 133.7
[M+Na]+ 166.12023 142.5
[M+NH4]+ 161.16483 141.1
[M+K]+ 182.09417 136.9
[M-H]- 142.12373 133.3
[M+Na-2H]- 164.10568 136.6
[M]+ 143.13046 134.5
[M]- 143.13156 134.5
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