CID 57389

Brn 5668769

Structural Information

Molecular Formula
C25H38N4O5
SMILES
CC(C)CCOC1=CC=C(C=C1)C2(C(=O)N(C(=O)N2CN3CCOCC3)CN4CCOCC4)C
InChI
InChI=1S/C25H38N4O5/c1-20(2)8-13-34-22-6-4-21(5-7-22)25(3)23(30)28(18-26-9-14-32-15-10-26)24(31)29(25)19-27-11-16-33-17-12-27/h4-7,20H,8-19H2,1-3H3
InChIKey
KNCJPWUQIYTCDU-UHFFFAOYSA-N
Compound name
5-methyl-5-[4-(3-methylbutoxy)phenyl]-1,3-bis(morpholin-4-ylmethyl)imidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

474.2842 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 475.29148 218.0
[M+Na]+ 497.27342 219.3
[M-H]- 473.27692 224.4
[M+NH4]+ 492.31802 220.1
[M+K]+ 513.24736 217.6
[M+H-H2O]+ 457.28146 205.3
[M+HCOO]- 519.28240 223.3
[M+CH3COO]- 533.29805 236.1
[M+Na-2H]- 495.25887 211.5
[M]+ 474.28365 215.4
[M]- 474.28475 215.4
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.