CID 78689

2-imidazolidinone, 1-octadecyl-

Structural Information

Molecular Formula
C21H42N2O
SMILES
CCCCCCCCCCCCCCCCCCN1CCNC1=O
InChI
InChI=1S/C21H42N2O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-23-20-18-22-21(23)24/h2-20H2,1H3,(H,22,24)
InChIKey
BTHOZYQLVNAFEX-UHFFFAOYSA-N
Compound name
1-octadecylimidazolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

31
Patents

338.3297 Da
Monoisotopic Mass

8.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 339.33698 193.9
[M+Na]+ 361.31892 200.4
[M+NH4]+ 356.36352 198.7
[M+K]+ 377.29286 193.5
[M-H]- 337.32242 192.5
[M+Na-2H]- 359.30437 193.3
[M]+ 338.32915 193.9
[M]- 338.33025 193.9
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