CID 54049284

N,n'-ethylenebis(montanamide)

Structural Information

Molecular Formula
C58H116N2O2
SMILES
CCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)NCCNC(=O)CCCCCCCCCCCCCCCCCCCCCCCCCCC
InChI
InChI=1S/C58H116N2O2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-45-47-49-51-53-57(61)59-55-56-60-58(62)54-52-50-48-46-44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-56H2,1-2H3,(H,59,61)(H,60,62)
InChIKey
LRTGNJNPQZYCSX-UHFFFAOYSA-N
Compound name
N-[2-(octacosanoylamino)ethyl]octacosanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

50
Patents

872.9037 Da
Monoisotopic Mass

26.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 873.91098 332.8
[M+Na]+ 895.89292 337.0
[M+NH4]+ 890.93752 332.2
[M+K]+ 911.86686 338.4
[M-H]- 871.89642 312.8
[M+Na-2H]- 893.87837 325.5
[M]+ 872.90315 328.6
[M]- 872.90425 328.6
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