CID 116712

70851-63-7

Structural Information

Molecular Formula
C11H20N4O8
SMILES
C(CO)N1C(C(N(C1=O)CN2C(C(N(C2=O)CCO)O)O)O)O
InChI
InChI=1S/C11H20N4O8/c16-3-1-12-6(18)8(20)14(10(12)22)5-15-9(21)7(19)13(2-4-17)11(15)23/h6-9,16-21H,1-5H2
InChIKey
SBAOYXDIGGVJKY-UHFFFAOYSA-N
Compound name
1-[[4,5-dihydroxy-3-(2-hydroxyethyl)-2-oxoimidazolidin-1-yl]methyl]-4,5-dihydroxy-3-(2-hydroxyethyl)imidazolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

336.1281 Da
Monoisotopic Mass

-4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 337.13538 178.2
[M+Na]+ 359.11732 181.8
[M+NH4]+ 354.16192 177.7
[M+K]+ 375.09126 187.2
[M-H]- 335.12082 171.5
[M+Na-2H]- 357.10277 172.3
[M]+ 336.12755 175.6
[M]- 336.12865 175.6
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