CID 12332

Hexanamide

Structural Information

Molecular Formula
C6H13NO
SMILES
CCCCCC(=O)N
InChI
InChI=1S/C6H13NO/c1-2-3-4-5-6(7)8/h2-5H2,1H3,(H2,7,8)
InChIKey
ALBYIUDWACNRRB-UHFFFAOYSA-N
Compound name
hexanamide
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

41
References

25508
Patents

115.09972 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 116.10700 124.8
[M+Na]+ 138.08894 134.0
[M+NH4]+ 133.13354 132.6
[M+K]+ 154.06288 129.0
[M-H]- 114.09244 124.6
[M+Na-2H]- 136.07439 128.2
[M]+ 115.09917 125.7
[M]- 115.10027 125.7
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