CID 173214

Decanamide, n-(3-aminopropyl)-

Structural Information

Molecular Formula
C13H28N2O
SMILES
CCCCCCCCCC(=O)NCCCN
InChI
InChI=1S/C13H28N2O/c1-2-3-4-5-6-7-8-10-13(16)15-12-9-11-14/h2-12,14H2,1H3,(H,15,16)
InChIKey
PLJISUVFPNUOBK-UHFFFAOYSA-N
Compound name
N-(3-aminopropyl)decanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

228.22017 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.22745 161.1
[M+Na]+ 251.20939 163.8
[M-H]- 227.21289 159.5
[M+NH4]+ 246.25399 178.4
[M+K]+ 267.18333 161.6
[M+H-H2O]+ 211.21743 154.4
[M+HCOO]- 273.21837 183.4
[M+CH3COO]- 287.23402 198.7
[M+Na-2H]- 249.19484 162.5
[M]+ 228.21962 162.4
[M]- 228.22072 162.4
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