CID 61978

38304-52-8

Structural Information

Molecular Formula
C22H32N4O8
SMILES
CC1(C(=O)N(C(=O)N1CC2CO2)CC(CN3C(=O)C(N(C3=O)CC4CO4)(C)C)OCC5CO5)C
InChI
InChI=1S/C22H32N4O8/c1-21(2)17(27)23(19(29)25(21)7-14-9-32-14)5-13(31-11-16-12-34-16)6-24-18(28)22(3,4)26(20(24)30)8-15-10-33-15/h13-16H,5-12H2,1-4H3
InChIKey
RXBBSTXUVVVWRC-UHFFFAOYSA-N
Compound name
3-[3-[4,4-dimethyl-3-(oxiran-2-ylmethyl)-2,5-dioxoimidazolidin-1-yl]-2-(oxiran-2-ylmethoxy)propyl]-5,5-dimethyl-1-(oxiran-2-ylmethyl)imidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

1314
Patents

480.22202 Da
Monoisotopic Mass

-1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 481.22930 148.7
[M+Na]+ 503.21124 158.4
[M+NH4]+ 498.25584 154.2
[M+K]+ 519.18518 162.1
[M-H]- 479.21474 166.1
[M+Na-2H]- 501.19669 158.5
[M]+ 480.22147 157.3
[M]- 480.22257 157.3
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