CID 559169

N-(2-hydroxyethyl)octanamide

Structural Information

Molecular Formula
C10H21NO2
SMILES
CCCCCCCC(=O)NCCO
InChI
InChI=1S/C10H21NO2/c1-2-3-4-5-6-7-10(13)11-8-9-12/h12H,2-9H2,1H3,(H,11,13)
InChIKey
GSILMNFJLONLCJ-UHFFFAOYSA-N
Compound name
N-(2-hydroxyethyl)octanamide
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

0
References

413
Patents

187.15723 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.16451 147.2
[M+Na]+ 210.14645 151.5
[M-H]- 186.14995 145.3
[M+NH4]+ 205.19105 166.0
[M+K]+ 226.12039 150.1
[M+H-H2O]+ 170.15449 141.6
[M+HCOO]- 232.15543 168.8
[M+CH3COO]- 246.17108 184.7
[M+Na-2H]- 208.13190 150.5
[M]+ 187.15668 148.7
[M]- 187.15778 148.7
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