CID 280049

N-[2-(hexanoylamino)ethyl]hexanamide

Structural Information

Molecular Formula
C14H28N2O2
SMILES
CCCCCC(=O)NCCNC(=O)CCCCC
InChI
InChI=1S/C14H28N2O2/c1-3-5-7-9-13(17)15-11-12-16-14(18)10-8-6-4-2/h3-12H2,1-2H3,(H,15,17)(H,16,18)
InChIKey
JUFADMDNFLYBPC-UHFFFAOYSA-N
Compound name
N-[2-(hexanoylamino)ethyl]hexanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

56
Patents

256.2151 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.222376 167.9
[M+Na]+ 279.204318 170.2
[M-H]- 255.207824 166.8
[M+NH4]+ 274.248923 184.2
[M+K]+ 295.178258 168.6
[M+H-H2O]+ 239.212360 160.9
[M+HCOO]- 301.213301 190.0
[M+CH3COO]- 315.228951 203.6
[M+Na-2H]- 277.189766 168.6
[M]+ 256.21455142 170.5
[M]- 256.21564858 170.5
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