CID 21151256

Decanamide, n-(3-(dimethyloxidoamino)propyl)-

Structural Information

Molecular Formula
C15H32N2O2
SMILES
CCCCCCCCCC(=O)NCCC[N+](C)(C)[O-]
InChI
InChI=1S/C15H32N2O2/c1-4-5-6-7-8-9-10-12-15(18)16-13-11-14-17(2,3)19/h4-14H2,1-3H3,(H,16,18)
InChIKey
MPXCYFACEXGWMI-UHFFFAOYSA-N
Compound name
3-(decanoylamino)-N,N-dimethylpropan-1-amine oxide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

4
Patents

272.24637 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.253646 171.7
[M+Na]+ 295.235588 174.1
[M-H]- 271.239094 170.6
[M+NH4]+ 290.280193 187.6
[M+K]+ 311.209528 167.8
[M+H-H2O]+ 255.243630 170.4
[M+HCOO]- 317.244571 193.2
[M+CH3COO]- 331.260221 200.2
[M+Na-2H]- 293.221036 176.1
[M]+ 272.24582142 173.5
[M]- 272.24691858 173.5
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