CID 11144482

Schembl9334414

Structural Information

Molecular Formula
C26H42N2O3
SMILES
CCCCCCCCCCCCCCCCOC1C(=O)NC(=O)N1CC2=CC=CC=C2
InChI
InChI=1S/C26H42N2O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-21-31-25-24(29)27-26(30)28(25)22-23-19-16-15-17-20-23/h15-17,19-20,25H,2-14,18,21-22H2,1H3,(H,27,29,30)
InChIKey
KMIDPUDEXUCFMX-UHFFFAOYSA-N
Compound name
1-benzyl-5-hexadecoxyimidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

86
Patents

430.31955 Da
Monoisotopic Mass

8.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 431.32683 214.9
[M+Na]+ 453.30877 223.1
[M+NH4]+ 448.35337 218.6
[M+K]+ 469.28271 216.1
[M-H]- 429.31227 215.0
[M+Na-2H]- 451.29422 215.8
[M]+ 430.31900 215.6
[M]- 430.32010 215.6
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