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]+ 257.22238 167.9
[M+Na]+ 279.20432 170.2
[M-H]- 255.20782 166.8
[M+NH4]+ 274.24892 184.2
[M+K]+ 295.17826 168.6
[M+H-H2O]+ 239.21236 160.9
[M+HCOO]- 301.21330 190.0
[M+CH3COO]- 315.22895 203.6
[M+Na-2H]- 277.18977 168.6
[M]+ 256.21455 170.5
[M]- 256.21565 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.