CID 3067796

Butanamide, n-hexyl-4-((1-oxobutyl)amino)-

Structural Information

Molecular Formula
C14H28N2O2
SMILES
CCCCCCNC(=O)CCCNC(=O)CCC
InChI
InChI=1S/C14H28N2O2/c1-3-5-6-7-11-15-14(18)10-8-12-16-13(17)9-4-2/h3-12H2,1-2H3,(H,15,18)(H,16,17)
InChIKey
VNYLNAWOYNBHOG-UHFFFAOYSA-N
Compound name
4-(butanoylamino)-N-hexylbutanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

256.2151 Da
Monoisotopic Mass

2.3
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

No literature data available for this compound.

Patent stripe

No patent data available for this compound.