CID 11144482

Schembl8652682

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

96
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 212.7
[M+Na]+ 453.30877 214.3
[M-H]- 429.31227 212.7
[M+NH4]+ 448.35337 220.7
[M+K]+ 469.28271 207.6
[M+H-H2O]+ 413.31681 202.0
[M+HCOO]- 475.31775 227.6
[M+CH3COO]- 489.33340 228.9
[M+Na-2H]- 451.29422 207.4
[M]+ 430.31900 217.0
[M]- 430.32010 217.0
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